Oleic acid, butyl ester
- Formula: C22H42O2
- Molecular weight: 338.5677
- IUPAC Standard InChIKey: WIBFFTLQMKKBLZ-SEYXRHQNSA-N
- CAS Registry Number: 142-77-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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- Stereoisomers:
- Other names: (Z)-9-Octadecenoic acid butyl ester; Butyl oleate; 9-Octadecenoic acid (Z)-, butyl ester; Advaplast 42; Hallco C-503 Plasticizer; Kessco 554; Kesscoflex BO; Wilmar Butyl Oleate; Witcizer 100; Witcizer 101; 9-Octadecenoic acid, butyl ester (Z)-; Plasthall 503; Uniflex byo; Butyl 9-octadecenoate, cis-; Emerest 2328; Kemester 4000; n-Butyl oleate; 9-Octadecenoic acid (9Z)-, butyl ester; Butyl cis-9-octadecenoate; Hallco C 503; Plasthall 914
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Condensed phase thermochemistry data
Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), References, Notes
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°liquid | -3308.5 ± 3.3 | kcal/mol | Ccb | Keffler, 1937 | Reanalyzed by Cox and Pilcher, 1970, Original value = -3302.3 kcal/mol; See Keffler and McLean, 1935; Corresponding ΔfHºliquid = -195.24 kcal/mol (simple calculation by NIST; no Washburn corrections) |
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 by: William E. Acree, Jr., James S. Chickos
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
23.4 | 368. | A | Stephenson and Malanowski, 1987 | Based on data from 353. to 393. K. |
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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Gas Phase Spectrum
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Additional Data
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Owner | NIST Standard Reference Data Program Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Sadtler Research Labs Under US-EPA Contract |
State | gas |
Mass spectrum (electron ionization)
Go To: Top, Condensed phase thermochemistry data, Phase change data, IR Spectrum, References, Notes
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
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Japan AIST/NIMC Database- Spectrum MS-IW-3181 |
NIST MS number | 227542 |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Keffler, 1937
Keffler, L.J.P.,
Homology and isomerism in long-chain compounds. I. A thermochemical study of the n-alkyl esters derived from the monoethylenic monocarboxylic acids in C18,
J. Phys. Chem., 1937, 41, 715-721. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]
Keffler and McLean, 1935
Keffler, L.; McLean, J.H.,
Homology in long-chain compounds, I. Oleic acid and the n-alkul oleates,
J. Soc. Chem. Ind., 1935, 178-185. [all data]
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), References
- Symbols used in this document:
ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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