Trans-1-chloro-1-butene
- Formula: C4H7Cl
- Molecular weight: 90.551
- IUPAC Standard InChIKey: DUDKKPVINWLFBI-ONEGZZNKSA-N
- CAS Registry Number: 7611-87-2
- Chemical structure:
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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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -3.95 | kcal/mol | Eqk | Levanova, Rodova, et al., 1974 |
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
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 341.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Tboil | 341.25 | K | N/A | Kinney, 1942 | Uncertainty assigned by TRC = 1. K; uncertain whether this was measured; TRC |
Tboil | 341.25 | K | N/A | Navez, 1930 | Uncertainty assigned by TRC = 1. K; TRC |
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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
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
By formula: C4H8Cl2 = C4H7Cl + HCl
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 15.29 ± 0.09 | kcal/mol | Eqk | Rodova, Shevtsova, et al., 1974 | gas phase |
By formula: C4H7Cl = C4H7Cl
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -0.68 ± 0.07 | kcal/mol | Eqk | Rodova, Shevtsova, et al., 1974 | gas phase |
IR Spectrum
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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: Coblentz Society, Inc.
Spectrum
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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.
Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Owner | COBLENTZ SOCIETY Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | W.T. BOLLETER |
Source reference | COBLENTZ NO. 4508 |
Date | Not specified, most likely prior to 1970 |
Name(s) | (1E)-1-chloro-1-butene |
Instrument | Not specified, most likely a prism, grating, or hybrid spectrometer. |
Path length | 0.0025 CM |
Resolution | 4 |
Sampling procedure | TRANSMISSION |
Data processing | DIGITIZED BY NIST FROM HARD COPY |
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.
Levanova, Rodova, et al., 1974
Levanova, S.V.; Rodova, R.M.; Rozhnov, A.M.; Shevtsova, L.A.,
Thermodynamic calculation of the equilibrium composition of chlorobutene mixtures,
Russ. J. Phys. Chem. (Engl. Transl.), 1974, 48, 1113-1114. [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]
Kinney, 1942
Kinney, C.R.,
A System Correlating Molecular Structure of Organic Compounds with Their Boiling Points VI. The Monohalogen Derivatives of the Various Hydrocarbons,
J. Org. Chem., 1942, 7, 111. [all data]
Navez, 1930
Navez, L.,
Bull. Soc. Chim. Belg., 1930, 39, 435. [all data]
Rodova, Shevtsova, et al., 1974
Rodova, R.M.; Shevtsova, L.A.; Levanova, S.V.; Rozhnov, A.M.; Garkushin, I.K.,
Dehydrochlorination of 1,1-dichlorobutane and isomerization of chlorobutenes,
Izv. Vyssh. Uchebn. Zaved., Khim. Khim. Tekhnol., 1974, 17, 379-381. [all data]
Notes
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- Symbols used in this document:
Tboil Boiling point ΔfH°gas Enthalpy of formation of gas at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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