n-Propyl chloroformate

• Formula: C₄H₇ClO₂
• Molecular weight: 122.550
• IUPAC Standard InChI: InChI=1S/C4H7ClO2/c1-2-3-7-4(5)6/h2-3H2,1H3 Copy

  
• IUPAC Standard InChIKey: QQKDTTWZXHEGAQ-UHFFFAOYSA-N Copy
• CAS Registry Number: 109-61-5
• 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: Carbonochloridic acid, propyl ester; Formic acid, chloro-, propyl ester; Propyl chlorocarbonate; Propyl chloroformate; chloroformic acid propylester; UN 2740
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• Information on this page:
  • Condensed phase thermochemistry data
  • Phase change data
  • Mass spectrum (electron ionization)
  • Gas Chromatography
  • References
  • Notes
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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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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

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

Gas Chromatography

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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

Normal alkane RI, non-polar column, custom temperature program

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References

Go To: Top, Condensed phase thermochemistry data, Phase change data, Mass spectrum (electron ionization), Gas Chromatography, Notes

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

Finch and Salem, 1987
Finch, A.; Salem, K.M.M., Standard enthalpies of formation of n-propylchloroformate and benzyl chloroformate vial solution calorimetry, Thermochim. Acta, 1987, 116, 65-69. [all data]

Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc., Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]

Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]

Finch and Salem, 1987, 2
Finch, A.; Salem, K.M.M., Standard Enthalpies of Formation of n-Propylchloroformate and Benzyl Chloroformate via Solution Calorimetry, Thermochim. Acta, 1987, 116, 65. [all data]

Davies, Finch, et al., 1990
Davies, R.H.; Finch, A.; Salem, K., Enthalpies of vaporization and vapour pressures of n-propylchloroformate and benzylchloroformate, Thermochim. Acta, 1990, 170, 213-216. [all data]

Zenkevich, Eliseenkov, et al., 2006
Zenkevich, I.G.; Eliseenkov, E.V.; Kasatochkin, A.N., Application of Retention Indices in GC-MS Identification of Halogenated Organic Compounds, Mass Spectromery (Rus.), 2006, 3, 2, 131-140. [all data]

Notes

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• Symbols used in this document:
  

  Tboil	Boiling point
  ΔfH°liquid	Enthalpy of formation of liquid at standard conditions
  ΔvapH°	Enthalpy of vaporization at standard conditions

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