1-Hexanol - The NIST WebBook

1-Hexanol

• Formula: C6H14O
• Molecular weight: 102.1748
• IUPAC Standard InChI: InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3 Copy
• IUPAC Standard InChIKey: ZSIAUFGUXNUGDI-UHFFFAOYSA-N Copy
• CAS Registry Number: 111-27-3
• Chemical structure: This structure is also available as a 2d Mol file or as a computed 3d SD file View 3d structure (requires JavaScript / HTML 5)
• Isotopologues:
  • hexanol-d3
  • hexyl-d11 acetate
• Other names: Hexyl alcohol; n-Hexan-1-ol; n-Hexanol; n-Hexyl alcohol; Amylcarbinol; Caproyl alcohol; Hexanol; Pentylcarbinol; 1-Hexyl alcohol; 1-Hydroxyhexane; n-C6H13OH; Hexan-1-ol; Hexanol-(1); Epal 6; NSC 9254
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• Information on this page:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • Reaction thermochemistry data
  • Henry's Law data
  • Gas phase ion energetics data
  • Ion clustering data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • References
  • Notes
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Gas phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments: DRB - Donald R. Burgess, Jr. ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein GT - Glushko Thermocenter, Russian Academy of Sciences, Moscow

Quantity	Value	Units	Method	Reference	Comment
ΔfH°gas	-316. ± 10.	kJ/mol	AVG	N/A	Average of 7 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
S°gas	439.7 ± 2.1	J/mol*K	N/A	Green J.H.S., 1961	Other third-law value of entropy at 298.15 K is 441.41(4.18) J/mol*K [ Chermin H.A.G., 1961].; GT

Condensed phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments: ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity	Value	Units	Method	Reference	Comment
ΔfH°liquid	-377.5 ± 0.44	kJ/mol	Ccb	Mosselman and Dekker, 1975	ALS
ΔfH°liquid	-379.4 ± 1.0	kJ/mol	Ccb	Chao and Rossini, 1965	see Rossini, 1934; ALS
ΔfH°liquid	-383.9 ± 2.0	kJ/mol	Ccb	Green, 1960	ALS
ΔfH°liquid	-387.7	kJ/mol	Cm	Kelley, 1929	hfusion=3.68 kcal/mol; ALS
Quantity	Value	Units	Method	Reference	Comment
ΔcH°liquid	-3984.37 ± 0.44	kJ/mol	Ccb	Mosselman and Dekker, 1975	Corresponding ΔfHºliquid = -377.50 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
ΔcH°liquid	-3982.6 ± 0.92	kJ/mol	Ccb	Chao and Rossini, 1965	see Rossini, 1934; Corresponding ΔfHºliquid = -379.3 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
ΔcH°liquid	-3978.1 ± 2.0	kJ/mol	Ccb	Green, 1960	Corresponding ΔfHºliquid = -383.8 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
ΔcH°liquid	-3978.1	kJ/mol	Ccb	Verkade and Coops, 1927	Corrected for 298 and 1 atm.; Corresponding ΔfHºliquid = -383.8 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Quantity	Value	Units	Method	Reference	Comment
S°liquid	287.4	J/mol*K	N/A	Kelley, 1929, 2	DH

Constant pressure heat capacity of liquid

Cp,liquid (J/mol*K)	Temperature (K)	Reference	Comment
243.2	298.15	Atrashenok, Nesterov, et al., 1991	T = 227 to 363 K. Cp(liq) = 2.37095 - 0.0851173(T/100) - 0.195794(T/100)2 - 0.00639224(T/100)3 + 0.0530459(T/100)4 - 0.00859433(T/100)5 kJ/kg*K.; DH
242.5	298.15	Vesely, Barcal, et al., 1989	T = 298.15 to 318.15 K.; DH
241.32	298.15	Andreoli-Ball, Patterson, et al., 1988	DH
237.85	298.15	Ortega, 1986	DH
240.57	298.15	Tanaka, Toyama, et al., 1986	DH
239.68	298.15	Costas and Patterson, 1985	T = 283.15, 298.15, 313.15 K.; DH
239.62	298.15	Bravo, Pintos, et al., 1984	DH
249.15	300.607	Kalinowska and Woycicki, 1984	T = 230 to 300 K. Value is unsmoothed experimental datum.; DH
241.32	298.15	Zegers and Somsen, 1984	DH
240.65	298.15	Benson, D'Arcy, et al., 1983	DH
236.5	293.15	Arutyunyan, 1981	T = 273 to 533 K. p = 0.1 MPa. Unsmoothed experimental datum at 293.15 K, Cp = 2.315 kJ/kg*K.; DH
236.5	293.15	Arutyunyan, 1981	T = 293 to 393 K. p = 0.1 MPa. Unsmoothed experimental datum given as 2.315 kJ/kg*K. Cp given from 293.15 to 533.15 K for pressure range 10 to 60 MPa.; DH
247.7	303.74	Griigo'ev, Yanin, et al., 1979	T = 303 to 462 K. p = 0.98 bar.; DH
244.8	298.	Hutchinson and Bailey, 1959	DH
232.46	290.01	Kelley, 1929, 2	T = 16 to 298 K. Value is unsmoothed experimental datum.; DH

Phase change data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments: BS - Robert L. Brown and Stephen E. Stein TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director AC - William E. Acree, Jr., James S. Chickos ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein DRB - Donald R. Burgess, Jr. DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity	Value	Units	Method	Reference	Comment
Tboil	430. ± 2.	K	AVG	N/A	Average of 54 out of 59 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
Tfus	225. ± 5.	K	AVG	N/A	Average of 6 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
Ttriple	225.8	K	N/A	Kelley, 1929, 3	Uncertainty assigned by TRC = 0.3 K; TRC
Quantity	Value	Units	Method	Reference	Comment
Tc	610.5 ± 0.9	K	AVG	N/A	Average of 8 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
Pc	34.2 ± 0.2	bar	N/A	Gude and Teja, 1995
Pc	34.20	bar	N/A	Quadri, Khilar, et al., 1991	Uncertainty assigned by TRC = 0.50 bar; TRC
Pc	34.13	bar	N/A	Rosenthal and Teja, 1990	Uncertainty assigned by TRC = 0.06 bar; TRC
Pc	34.13	bar	N/A	Rosenthal and Teja, 1989	Uncertainty assigned by TRC = 0.20 bar; TRC
Quantity	Value	Units	Method	Reference	Comment
Vc	0.387	l/mol	N/A	Gude and Teja, 1995
Quantity	Value	Units	Method	Reference	Comment
ρc	2.58 ± 0.02	mol/l	N/A	Gude and Teja, 1995
ρc	2.62	mol/l	N/A	Teja, Lee, et al., 1989	TRC
ρc	2.54	mol/l	N/A	Anselme and Teja, 1988	Uncertainty assigned by TRC = 0.06 mol/l; TRC
ρc	2.62	mol/l	N/A	Efremov, 1966	Uncertainty assigned by TRC = 0.03 mol/l; TRC
Quantity	Value	Units	Method	Reference	Comment
ΔvapH°	61. ± 2.	kJ/mol	AVG	N/A	Average of 13 out of 14 values; Individual data points

Enthalpy of vaporization

ΔvapH (kJ/mol)	Temperature (K)	Method	Reference	Comment
44.5	430.5	N/A	Majer and Svoboda, 1985
59.7	359.	EB	Gierycz, Kosowski, et al., 2009	Based on data from 344. to 384. K.; AC
51.4	385.	EB	Tan, Li, et al., 2004	Based on data from 370. to 416. K.; AC
62.0	288.	GS	Kulikov, Verevkin, et al., 2001	Based on data from 265. to 328. K.; AC
61.9 ± 0.2	301.	GS	Verevkin, 1998	Based on data from 268. to 333. K.; AC
61.2	296.	N/A	N'Guimbi, Kasehgari, et al., 1992	Based on data from 253. to 338. K.; AC
57.7	313.	A	Stephenson and Malanowski, 1987	Based on data from 298. to 343. K.; AC
58.5	340.	DTA	Stephenson and Malanowski, 1987	Based on data from 325. to 431. K. See also Kemme and Kreps, 1969.; AC
58.5 ± 0.2	328.	C	Majer, Svoboda, et al., 1985	AC
57.6 ± 0.2	343.	C	Majer, Svoboda, et al., 1985	AC
55.2 ± 0.2	358.	C	Majer, Svoboda, et al., 1985	AC
53.8 ± 0.2	368.	C	Majer, Svoboda, et al., 1985	AC
47.9	395.	EB	Reddy, Rao, et al., 1985	Based on data from 380. to 417. K.; AC
57.9	323.	N/A	Wilhoit and Zwolinski, 1973	Based on data from 308. to 430. K.; AC
56.0	349.	N/A	Rose and Supina, 1961	Based on data from 334. to 381. K.; AC
57.9	348.	N/A	Butler, Ramchandani, et al., 1935	Based on data from 333. to 425. K. See also Boublik, Fried, et al., 1984.; AC

Enthalpy of vaporization

ΔvapH = A exp(-αTr) (1 − Tr)β ΔvapH = Enthalpy of vaporization (at saturation pressure) (kJ/mol) Tr = reduced temperature (T / Tc)

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Temperature (K)	298. to 368.
A (kJ/mol)	72.06
α	-1.059
β	1.0052
Tc (K)	610.
Reference	Majer and Svoboda, 1985

Antoine Equation Parameters

log10(P) = A − (B / (T + C)) P = vapor pressure (bar) T = temperature (K)

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Temperature (K)	A	B	C	Reference	Comment
325.4 to 430.5	4.41271	1422.031	-107.706	Kemme and Kreps, 1969
334.1 to 381.7	5.64356	2117.967	-51.988	Rose and Supina, 1961	Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kJ/mol)	Temperature (K)	Reference	Comment
15.380	225.8	Kelley, 1929, 2	DH
15.48	225.8	Domalski and Hearing, 1996	AC

Entropy of fusion

ΔfusS (J/mol*K)	Temperature (K)	Reference	Comment
68.11	225.8	Kelley, 1929, 2	DH

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Reaction thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments: B - John E. Bartmess M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

C6H13O- + =

By formula: C6H13O- + H+ = C6H14O

Quantity	Value	Units	Method	Reference	Comment
ΔrH°	1565. ± 8.8	kJ/mol	G+TS	Higgins and Bartmess, 1998	gas phase; B
ΔrH°	1565. ± 13.	kJ/mol	CIDC	Haas and Harrison, 1993	gas phase; Kinetic method gives energy-dependent results.; B
ΔrH°	1561. ± 12.	kJ/mol	G+TS	Boand, Houriet, et al., 1983	gas phase; value altered from reference due to change in acidity scale; B
Quantity	Value	Units	Method	Reference	Comment
ΔrG°	1537. ± 8.4	kJ/mol	IMRE	Higgins and Bartmess, 1998	gas phase; B
ΔrG°	1538. ± 13.	kJ/mol	H-TS	Haas and Harrison, 1993	gas phase; Kinetic method gives energy-dependent results.; B
ΔrG°	1533. ± 11.	kJ/mol	CIDC	Boand, Houriet, et al., 1983	gas phase; value altered from reference due to change in acidity scale; B

C3H9Sn+ + = (C3H9Sn+ • )

By formula: C3H9Sn+ + C6H14O = (C3H9Sn+ • C6H14O)

Quantity	Value	Units	Method	Reference	Comment
ΔrH°	157.	kJ/mol	PHPMS	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated; M
Quantity	Value	Units	Method	Reference	Comment
ΔrS°	139.	J/mol*K	N/A	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kJ/mol)	T (K)	Method	Reference	Comment
83.7	525.	PHPMS	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated; M

Henry's Law data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Rolf Sander

Henry's Law constant (water solution)

kH(T) = k°H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K))) k°H = Henry's law constant for solubility in water at 298.15 K (mol/(kg*bar)) d(ln(kH))/d(1/T) = Temperature dependence constant (K)

k°H (mol/(kg*bar))	d(ln(kH))/d(1/T) (K)	Method	Reference	Comment
53.	Q	N/A	missing citation give several references for the Henry's law constants but don't assign them to specific species.
65.	V	N/A
58.	M	Buttery, Ling, et al., 1969
64.	V	Butler, Ramchandani, et al., 1935, 2

Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments: B - John E. Bartmess MM - Michael M. Meot-Ner (Mautner) LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Proton affinity at 298K

Proton affinity (kJ/mol)	Reference	Comment
799.	Holmes, Aubry, et al., 1999	MM

Ionization energy determinations

IE (eV)	Method	Reference	Comment
9.89	PE	Ashmore and Burgess, 1977	LLK
10.35	PE	Ashmore and Burgess, 1977	Vertical value; LLK

Appearance energy determinations

Ion	AE (eV)	Other Products	Method	Reference	Comment
C2H4O+	~10.7	?	EI	Holmes, Terlouw, et al., 1976	LLK
C4H8+	9.89	?	EI	Holmes, Terlouw, et al., 1976	LLK

De-protonation reactions

C6H13O- + =

By formula: C6H13O- + H+ = C6H14O

Quantity	Value	Units	Method	Reference	Comment
ΔrH°	1565. ± 8.8	kJ/mol	G+TS	Higgins and Bartmess, 1998	gas phase; B
ΔrH°	1565. ± 13.	kJ/mol	CIDC	Haas and Harrison, 1993	gas phase; Kinetic method gives energy-dependent results.; B
ΔrH°	1561. ± 12.	kJ/mol	G+TS	Boand, Houriet, et al., 1983	gas phase; value altered from reference due to change in acidity scale; B
Quantity	Value	Units	Method	Reference	Comment
ΔrG°	1537. ± 8.4	kJ/mol	IMRE	Higgins and Bartmess, 1998	gas phase; B
ΔrG°	1538. ± 13.	kJ/mol	H-TS	Haas and Harrison, 1993	gas phase; Kinetic method gives energy-dependent results.; B
ΔrG°	1533. ± 11.	kJ/mol	CIDC	Boand, Houriet, et al., 1983	gas phase; value altered from reference due to change in acidity scale; B

Ion clustering data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Michael M. Meot-Ner (Mautner) and Sharon G. Lias

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. Searches may be limited to ion clustering reactions. A general reaction search form is also available.

Clustering reactions

C3H9Sn+ + = (C3H9Sn+ • )

By formula: C3H9Sn+ + C6H14O = (C3H9Sn+ • C6H14O)

Quantity	Value	Units	Method	Reference	Comment
ΔrH°	157.	kJ/mol	PHPMS	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated
Quantity	Value	Units	Method	Reference	Comment
ΔrS°	139.	J/mol*K	N/A	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kJ/mol)	T (K)	Method	Reference	Comment
83.7	525.	PHPMS	Stone and Splinter, 1984	gas phase; switching reaction((CH3)3Sn+)CH3OH, Entropy change calculated or estimated

IR Spectrum

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Data compiled by: Coblentz Society, Inc.

• SOLUTION (10% IN CCl4 FOR 3800-1300, 10% IN CS2 FOR 1300-650, 10% IN CCl4 FOR 650-250 CM-1) VERSUS SOLVENT; PERKIN-ELMER 521 (GRATING); DIGITIZED BY NIST FROM HARD COPY (FROM TWO SEGMENTS); 4 cm-1 resolution

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

• gas

Mass spectrum (electron ionization)

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

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Owner	NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved.
NIST MS number	19937

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References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Green J.H.S., 1961 Green J.H.S., Thermodynamic properties of the normal alcohols C1-C12, J. Appl. Chem., 1961, 11, 397-404. [all data]

Chermin H.A.G., 1961 Chermin H.A.G., Thermo data for petrochemicals. Part 28. Gaseous normal alcohols. The important thermo properties are presented for all the gaseous normal alcohols from methanol through n-decanol, Petrol. Refiner, 1961, 40 (4), 127-130. [all data]

Mosselman and Dekker, 1975 Mosselman, C.; Dekker, H., Enthalpies of formation of n-alkan-1-ols, J. Chem. Soc. Faraday Trans. 1, 1975, 417-424. [all data]

Chao and Rossini, 1965 Chao, J.; Rossini, F.D., Heats of combustion, formation, and isomerization of nineteen alkanols, J. Chem. Eng. Data, 1965, 10, 374-379. [all data]

Rossini, 1934 Rossini, F.D., Heats of combustion and of formation of the normal aliphatic alcohols in the gaseous and liquid states, and the energies of their atomic linkages, J. Res. NBS, 1934, 13, 189-197. [all data]

Green, 1960 Green, J.H.S., Revision of the values of the heats of formation of normal alcohols, Chem. Ind. (London), 1960, 1215-1216. [all data]

Kelley, 1929 Kelley, K.K., The heat capacities of ethyl and hexyl alcohols from 16°K. to 298°K. and the corresponding entropies and free energies and free energies, J. Am. Chem. Soc., 1929, 51, 779-781. [all data]

Verkade and Coops, 1927 Verkade, P.E.; Coops, J., Jr., Calorimetric researches XIV. Heats of combustion of successive members of homologous series: the normal primary aliphatic alcohols, Recl. Trav. Chim. Pays-Bas, 1927, 46, 903-917. [all data]

Kelley, 1929, 2 Kelley, K.K., The heat capacities of ethyl and hexyl alcohols from 16°K to 298°K and the corresponding entropies and free energies, J. Am. Chem. Soc., 1929, 51, 779-786. [all data]

Atrashenok, Nesterov, et al., 1991 Atrashenok, T.R.; Nesterov, N.A.; Zhuk, I.P.; Peshchenko, A.D., Measured specific heats of hexan-1-ol and 3-methyl-2-butanol over wide temperature ranges, Inzh.-Fiz. Zh., 1991, 61(2), 301-304. [all data]

Vesely, Barcal, et al., 1989 Vesely, F.; Barcal, P.; Zabransky, M.; Svoboda, V., Heat capacities of 4-methyl-2-pentanone, 2,6-dimethyl-4-heptanone, 1-hexanol, 1-heptanol, and 1-octanol in the temperature range 298-318 K, Collect. Czech. Chem. Commun., 1989, 54, 602-607. [all data]

Andreoli-Ball, Patterson, et al., 1988 Andreoli-Ball, L.; Patterson, D.; Costas, M.; Caceres-Alonso, M., Heat capacity and corresponding states in alkan-1-ol-n-alkane systems, J. Chem. Soc., Faraday Trans. 1, 1988, 84(11), 3991-4012. [all data]

Ortega, 1986 Ortega, J., Excess molar heat capacities of the binary mixtures of cyclohexane with isomers of hexanol at 298.15 K, Rev. Latinoam. Ing. Quim. Quim. Apl., 1986, 16, 307-315. [all data]

Tanaka, Toyama, et al., 1986 Tanaka, R.; Toyama, S.; Murakami, S., Heat capacities of {xCnH2n+1OH+(1-x)C7H16} for n = 1 to 6 at 298.15 K, J. Chem. Thermodynam., 1986, 18, 63-73. [all data]

Costas and Patterson, 1985 Costas, M.; Patterson, D., Self-association of alcohols in inert solvents, J. Chem. Soc., Faraday Trans. 1, 1985, 81, 635-654. [all data]

Bravo, Pintos, et al., 1984 Bravo, R.; Pintos, M.; Baluja, M.C.; Paz Andrade, M.I.; Roux-Desgranges, G.; Grolier, J.-P.E., Excess volumes excess heat capacities of some mixtures: (an isomer of hexanol + an n-alkane) at 298.15 K, J. Chem. Thermodynam., 1984, 16, 73-79. [all data]

Kalinowska and Woycicki, 1984 Kalinowska, B.; Woycicki, W., Heat capacities of liquids in the temperature interval between 90 and 300 K and at atmospheric pressure. III. Heat capacities and excess heat capacities of (n-hexanol-1-ol + n-hexane), J. Chem. Thermodynam., 1984, 16, 609-613. [all data]

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Notes

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• Symbols used in this document:

  AE	Appearance energy
  Cp,liquid	Constant pressure heat capacity of liquid
  Pc	Critical pressure
  S°gas	Entropy of gas at standard conditions
  S°liquid	Entropy of liquid at standard conditions
  T	Temperature
  Tboil	Boiling point
  Tc	Critical temperature
  Tfus	Fusion (melting) point
  Ttriple	Triple point temperature
  Vc	Critical volume
  d(ln(kH))/d(1/T)	Temperature dependence parameter for Henry's Law constant
  k°H	Henry's Law constant at 298.15K
  ΔcH°liquid	Enthalpy of combustion of liquid at standard conditions
  ΔfH°gas	Enthalpy of formation of gas at standard conditions
  ΔfH°liquid	Enthalpy of formation of liquid at standard conditions
  ΔfusH	Enthalpy of fusion
  ΔfusS	Entropy of fusion
  ΔrG°	Free energy of reaction at standard conditions
  ΔrH°	Enthalpy of reaction at standard conditions
  ΔrS°	Entropy of reaction at standard conditions
  ΔvapH	Enthalpy of vaporization
  ΔvapH°	Enthalpy of vaporization at standard conditions
  ρc	Critical density

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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