1-Propanol, 3-chloro-

• Formula: C₃H₇ClO
• Molecular weight: 94.540
• IUPAC Standard InChI: InChI=1S/C3H7ClO/c4-2-1-3-5/h5H,1-3H2 Copy

  
• IUPAC Standard InChIKey: LAMUXTNQCICZQX-UHFFFAOYSA-N Copy
• CAS Registry Number: 627-30-5
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Trimethylene chlorohydrin; 1-Chloro-3-hydroxypropane; 3-Chloro-1-propanol; 3-Chloropropanol; 3-Chloropropane-1-ol; 3-Chlorpropan-1-ol; 3-Chloropropanol-1; UN 2849; 1-Chloro-3-propanol; 3-Chloro-1-hydroxypropane; Propanol, 3-chloro-; NSC 60190; 3-chloropropan-1-ol
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• Information on this page:
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
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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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
LL - Sharon G. Lias and Joel F. Liebman

Ionization energy determinations

Appearance energy determinations

References

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

Kimura, Katsumata, et al., 1981
Kimura, K.; Katsumata, S.; Achiba, Y.; Yamazaki, T.; Iwata, S., Ionization energies, Ab initio assignments, and valence electronic structure for 200 molecules in Handbook of HeI Photoelectron Spectra of Fundamental Organic Compounds, Japan Scientific Soc. Press, Tokyo, 1981. [all data]

Holmes and Lossing, 1988
Holmes, J.L.; Lossing, F.P., Heats of formation and bond dissociation energies in halogen-substituted methyl and ethyl radicals, J. Am. Chem. Soc., 1988, 110, 7343. [all data]

Notes

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• Symbols used in this document:
  

  AE	Appearance energy

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