Propanoic acid, 2,2-dimethyl-
- Formula: C5H10O2
- Molecular weight: 102.1317
- IUPAC Standard InChIKey: IUGYQRQAERSCNH-UHFFFAOYSA-N
- CAS Registry Number: 75-98-9
- 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: Pivalic acid; α,α-Dimethylpropionic acid; tert-Pentanoic acid; Neopentanoic acid; Trimethylacetic acid; 2,2-Dimethylpropanoic acid; 2,2-Dimethylpropionic acid; tert-C4H9COOH; Acetic acid, trimethyl-; Propionic acid, 2,2-dimethyl-; Kyselina 2,2-dimethylpropionova; Kyselina pivalova; NSC 65449; Neovaleric acid; Versatic 5
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Phase change 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:
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
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 436. ± 3. | K | AVG | N/A | Average of 27 out of 32 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 308. ± 3. | K | AVG | N/A | Average of 9 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 17.5 ± 0.72 | kcal/mol | V | Kruif and Oonk, 1979 | ALS |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
13.8 ± 0.05 | 320. | EB | Steele, Chirico, et al., 2002 | Based on data from 344. to 472. K.; AC |
13.0 ± 0.05 | 360. | EB | Steele, Chirico, et al., 2002 | Based on data from 344. to 472. K.; AC |
12.2 ± 0.05 | 400. | EB | Steele, Chirico, et al., 2002 | Based on data from 344. to 472. K.; AC |
11.2 ± 0.1 | 440. | EB | Steele, Chirico, et al., 2002 | Based on data from 344. to 472. K.; AC |
Enthalpy of sublimation
ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
14.9 | 291. | GS | Verevkin, 2000 | AC |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
0.55 | 309.1 | Steele, Chirico, et al., 2002 | AC |
0.543 | 309.1 | Singh and Glicksman, 1990 | AC |
Enthalpy of phase transition
ΔHtrs (kcal/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.094 | 281. | crystaline, II | crystaline, I | Murrill and Breed, 1970 | DH |
0.5925 | 307. | crystaline, I | liquid | Murrill and Breed, 1970 | DH |
1.956 | 278.3 | crystaline, II | crystaline, I | Singh and Glicksman, 1990 | DH |
0.5421 | 309.085 | crystaline, I | liquid | Singh and Glicksman, 1990 | DH |
Entropy of phase transition
ΔStrs (cal/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
7.50 | 281. | crystaline, II | crystaline, I | Murrill and Breed, 1970 | DH |
1.9 | 307. | crystaline, I | liquid | Murrill and Breed, 1970 | DH |
References
Go To: Top, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Kruif and Oonk, 1979
Kruif, C.G.; Oonk, H.A.J.,
Enthalpies of vaporization and vapour pressures of seven aliphatic carboxylic acids,
J. Chem. Thermodyn., 1979, 11, 287-290. [all data]
Steele, Chirico, et al., 2002
Steele, W.V.; Chirico, R.D.; Cowell, A.B.; Knipmeyer, S.E.; Nguyen, A.,
Thermodynamic Properties and Ideal-Gas Enthalpies of Formation for trans -Methyl Cinnamate, α-Methyl Cinnamaldehyde, Methyl Methacrylate, 1-Nonyne, Trimethylacetic Acid, Trimethylacetic Anhydride, and Ethyl Trimethyl Acetate,
J. Chem. Eng. Data, 2002, 47, 4, 700-714, https://doi.org/10.1021/je010086r
. [all data]
Verevkin, 2000
Verevkin, S.P.,
Measurement and Prediction of the Monocarboxylic Acids Thermochemical Properties,
J. Chem. Eng. Data, 2000, 45, 5, 953-960, https://doi.org/10.1021/je990282m
. [all data]
Singh and Glicksman, 1990
Singh, N.B.; Glicksman, M.E.,
Physical properties of ultra-pure pivalic acid,
Thermochim. Acta, 1990, 159, 93-99. [all data]
Murrill and Breed, 1970
Murrill, E.; Breed, L.,
Solid-solid phase transitions determined by differential scanning calorimetry,
Thermochim. Acta, 1970, 1, 239-246. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔsubH Enthalpy of sublimation ΔsubH° Enthalpy of sublimation at standard conditions ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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