Carbamic acid, phenyl-, butyl ester
- Formula: C11H15NO2
- Molecular weight: 193.2423
- IUPAC Standard InChI: InChI=1S/C11H15NO2/c1-2-3-9-14-11(13)12-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,12,13)
- IUPAC Standard InChIKey: ZTIMKJROOYMUMU-UHFFFAOYSA-N
- CAS Registry Number: 1538-74-5
- 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: Carbanilic acid, butyl ester; Butyl carbanilate; Butyl N-phenylcarbamate; Butyl N-phenylurethane; Butylphenylurethane; Carbanilic acid, n-butyl ester; Phenylcarbamic acid butyl ester
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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
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔcH°solid | -6077. ± 3. | kJ/mol | Ccb | Zhuravlev, Serukhina, et al., 1965 |
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
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By formula: C7H5NO + C4H10O = C11H15NO2
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | -83.9 ± 4.4 | kJ/mol | Cm | Pannone and Macosko, 1987 | liquid phase |
| ΔrH° | -105. ± 1. | kJ/mol | Cm | Lovering and Laidler, 1962 | solid phase |
IR Spectrum
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Data compiled by: Coblentz Society, Inc.
- SOLID (2 mg / 100 mg KBr); Not specified, most likely a grating spectrometer.; DIGITIZED BY NIST FROM HARD COPY; 4 cm-1 resolution
- SOLID (KBr PELLET); Not specified, most likely a prism, grating, or hybrid spectrometer.; DIGITIZED BY NIST FROM HARD COPY; 4 cm-1 resolution
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.
Zhuravlev, Serukhina, et al., 1965
Zhuravlev, E.Z.; Serukhina, S.Ya.; Konstantinov, I.I.,
Heats of combustion of certain phenylcarbamate esters (carbanilates),
J. Appl. Chem. USSR (Engl. Transl.), 1965, 38, 2775-2776. [all data]
Pannone and Macosko, 1987
Pannone, M.C.; Macosko, C.W.,
Kinetics of isocyanate amine reactions,
J. Appl. Polym. Sci., 1987, 34, 2409-2432. [all data]
Lovering and Laidler, 1962
Lovering, E.G.; Laidler, K.J.,
Thermochemical studies of some alcohol-isocyanate reactions,
Can. J. Chem., 1962, 40, 26-30. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, IR Spectrum, References
- Symbols used in this document:
ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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