D-Alanine
- Formula: C3H7NO2
- Molecular weight: 89.0932
- IUPAC Standard InChIKey: QNAYBMKLOCPYGJ-REOHCLBHSA-N
- CAS Registry Number: 338-69-2
- 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. - Stereoisomers:
- Other names: D-α-Alanine; D-(-)-Alanine; Alanine, D-; Ba 2776; D(-)-α-Alanine
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Condensed 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:
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 |
---|---|---|---|---|---|
ΔfH°solid | -605. ± 3.5 | kJ/mol | Ccb | Contineanu and Marchidan, 1984 | Author was aware that data differs from previously reported values; ALS |
ΔfH°solid | -561.24 ± 0.59 | kJ/mol | Ccb | Huffman, Ellis, et al., 1936 | Reanalyzed by Cox and Pilcher, 1970, Original value = -564.05 kJ/mol; ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -1576. ± 3.5 | kJ/mol | Ccb | Contineanu and Marchidan, 1984 | Author was aware that data differs from previously reported values; ALS |
ΔcH°solid | -1619.6 ± 0.54 | kJ/mol | Ccb | Huffman, Ellis, et al., 1936 | ALS |
ΔcH°solid | -1639.9 | kJ/mol | Ccb | Emery and Benedict, 1911 | ALS |
ΔcH°solid | -1623.0 ± 0.2 | kJ/mol | Ccb | Wrede, 1911 | ALS |
Quantity | Value | Units | Method | Reference | Comment |
S°solid,1 bar | 132.2 | J/mol*K | N/A | Huffman and Borsook, 1932 | Extrapolation below 90 K, 37.15 J/mol*K.; DH |
Constant pressure heat capacity of solid
Cp,solid (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
120.8 | 296.8 | Huffman and Borsook, 1932 | T = 84 to 297 K. Value is unsmoothed experimental datum.; DH |
References
Go To: Top, Condensed phase thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Contineanu and Marchidan, 1984
Contineanu, I.; Marchidan, D.I.,
The enthalpies of combustion and formation of D-alanine, L-alanine, DL-alanine, and β-alanine,
Rev. Roum. Chim., 1984, 29, 43-48. [all data]
Huffman, Ellis, et al., 1936
Huffman, H.M.; Ellis, E.L.; Fox, S.W.,
Thermal data. VI. The heats of combustion and free energies of seven organic compounds containing nitrogen,
J. Am. Chem. Soc., 1936, 58, 1728-1733. [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]
Emery and Benedict, 1911
Emery, A.G.; Benedict, F.G.,
The heat of combustion of compounds of physiological importance,
Am. J. Physiol., 1911, 28, 301-307. [all data]
Wrede, 1911
Wrede, F.,
Uber die Bestimmung von Berbrennungswarmen mittels der kalorimetrischen Bombe unter Benutzung des Platinwiderstandsthermometers,
Z. Phys. Chem. (Leipzig), 1911, 81-94. [all data]
Huffman and Borsook, 1932
Huffman, H.M.; Borsook, H.,
Thermal data. I. The heat capacities, entropies and free energies of seven organic compounds containing nitrogen,
J. Am. Chem. Soc., 1932, 54, 4297-4301. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid S°solid,1 bar Entropy of solid at standard conditions (1 bar) ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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