Phenol, 2,6-dichloro- - The NIST WebBook

Phenol, 2,6-dichloro-

• Formula: C6H4Cl2O
• Molecular weight: 163.001
• IUPAC Standard InChI: InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H Copy
• IUPAC Standard InChIKey: HOLHYSJJBXSLMV-UHFFFAOYSA-N Copy
• CAS Registry Number: 87-65-0
• Chemical structure: This structure is also available as a 2d Mol file or as a computed 3d SD file The 3d structure may be viewed using Java or Javascript.
• Other names: 2,6-Dichlorophenol; 2,6-Dichlorfenol; Rcra waste number U082
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• Information on this page:
  • Normal alkane RI, non-polar column, custom temperature program
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • Gas phase ion energetics data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
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Normal alkane RI, non-polar column, custom temperature program

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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

Column type	Capillary	Capillary	Capillary	Capillary
Active phase	Methyl Silicone	PTE-5	Ultra-2	SE-30
Column length (m)	25.	25.
Carrier gas
Substrate
Column diameter (mm)	0.20	0.20
Phase thickness (μm)	0.33	0.33
Program	not specified	50 0C (2 min) 30 0C/min -> 200 0C 8 0C/min -> 280 0C (10 min)	50 0C (2 min) 30 0C/min -> 200 0C 8 0C/min -> 280 0C (10 min)	not specified
I	1189.	1227.	1228.	1206.
Reference	Yu and Zazhi, 2005	Nakano, Fujimori, et al., 1992	Nakano, Fujimori, et al., 1992	Peterson, 1992
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

References

Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes

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

Yu and Zazhi, 2005 Yu, H.; Zazhi, J., Relationship between chromatogram retention index and toxicity of chlorinated phenols and chlorinated benzenes to Guppy, J. Enviropn. Health (Chinese), 2005, 22, 6, 441-444. [all data]

Nakano, Fujimori, et al., 1992 Nakano, T.; Fujimori, K.; Takaishi, Y.; Okuno, T., GC/MS-SIM analysis of polychlorobenzenes, polychlorophenols and polychloronaphthalenes, Report of the Environmental Science Institute of Hyogo Prefecture, 1992, 24, 30-37. [all data]

Peterson, 1992 Peterson, K.L., Counter-Propagation Neural Networks in the Modeling and Prediction of Kovats Indices for Substituted Phenols, Anal. Chem., 1992, 64, 4, 379-386, https://doi.org/10.1021/ac00028a011 . [all data]

Notes

Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References

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