Isopropyl acetate
- Formula: C5H10O2
- Molecular weight: 102.1317
- IUPAC Standard InChI: InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
- IUPAC Standard InChIKey: JMMWKPVZQRWMSS-UHFFFAOYSA-N
- CAS Registry Number: 108-21-4
- 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: Acetic acid, 1-methylethyl ester; Acetic acid, isopropyl ester; 2-Acetoxypropane; 2-Propyl acetate; CH3COOCH(CH3)2; Acetate d'isopropyle; Isopropile(acetato di); Isopropyl ethanoate; Isopropyl (acetate d'); Isopropylacetaat; Isopropylacetat; Isopropylester kyseliny octove; UN 1220; Isopropyl ester of acetic acid; sec-Propyl acetate; Acetic acid, 2-propyl ester; 1-Methylethyl acetate; NSC 9295
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Data at other public NIST sites:
- Options:
Data at NIST subscription sites:
NIST subscription sites provide data under the NIST Standard Reference Data Program, but require an annual fee to access. The purpose of the fee is to recover costs associated with the development of data collections included in such sites. Your institution may already be a subscriber. Follow the links above to find out more about the data in these sites and their terms of usage.
Gas phase thermochemistry data
Go To: Top, References, Notes
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:
DRB - Donald R. Burgess, Jr.
GT - Glushko Thermocenter, Russian Academy of Sciences, Moscow
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°gas | -489.7 ± 3.7 | kJ/mol | N/A | Butwill and Rockenfeller, 1970 | Value computed using ΔfHliquid° value of -526.9±3.7 kj/mol from Butwill and Rockenfeller, 1970 and ΔvapH° value of 37.2±0.2 kj/mol from missing citation.; DRB |
Constant pressure heat capacity of gas
| Cp,gas (J/mol*K) | Temperature (K) | Reference | Comment |
|---|---|---|---|
| 154.31 ± 0.23 | 361.35 | von Geiseler G., 1973 | GT |
| 158.99 ± 0.24 | 376.91 | ||
| 163.59 ± 0.25 | 392.36 | ||
| 168.95 ± 0.25 | 411.00 |
References
Go To: Top, Gas phase thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Butwill and Rockenfeller, 1970
Butwill, M.E.; Rockenfeller, J.D.,
Heats of combustion and formation of ethyl acetate and isopropyl acetate,
Thermochim. Acta, 1970, 1, 289-295. [all data]
von Geiseler G., 1973
von Geiseler G.,
The heat capacity and the heat of vaporization of isomeric butylmethylketones and propylacetates,
Z. Phys. Chem. (Leipzig), 1973, 252, 170-176. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, References
- Symbols used in this document:
Cp,gas Constant pressure heat capacity of gas ΔfH°gas Enthalpy of formation of gas at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.