DL-Valine
- Formula: C5H11NO2
- Molecular weight: 117.1463
- IUPAC Standard InChIKey: KZSNJWFQEVHDMF-UHFFFAOYSA-N
- CAS Registry Number: 516-06-3
- 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: Valine, DL-; DL-α-Aminoisovaleric acid; DL-Val; Valine; 2-Amino-3-methylbutanoic acid, DL-; NSC 9755
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- Information on this page:
- Other data available:
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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 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 | -617.0 ± 1.0 | kJ/mol | Ccb | Ribeiro da Silva, Ribeiro da Silva, et al., 1992 | ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -2910.7 ± 1.9 | kJ/mol | Ccb | Vasil'ev, Borodin, et al., 1991 | ALS |
ΔcH°solid | -2933.9 ± 0.4 | kJ/mol | Ccb | Wrede, 1911 | ALS |
Constant pressure heat capacity of solid
Cp,solid (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
165. | 298. | Badelin, Kulikov, et al., 1990 | T = 298, 313, 333, 348 K.; DH |
164.5 | 298. | Kulikov, Kozlov, et al., 1989 | T = 298 to 348 K.; DH |
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 as indicated in comments:
RCD - Robert C. Dunbar
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
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
By formula: Na+ + C5H11NO2 = (Na+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 173. ± 13. | kJ/mol | IMRE | Gapeev and Dunbar, 2003 | Anchor glycine=38.5+-2.1; RCD |
ΔrH° | 173. | kJ/mol | CIDC | Kish, Ohanessian, et al., 2003 | Anchor alanine=39.89; RCD |
By formula: C5H10NO2+ + C5H11NO2 = (C5H10NO2+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 87.9 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; M |
By formula: C5H12NO2+ + C5H11NO2 = (C5H12NO2+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.6 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; M |
Ion clustering data
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, 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:
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
RCD - Robert C. Dunbar
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. Searches may be limited to ion clustering reactions. A general reaction search form is also available.
Clustering reactions
By formula: C5H10NO2+ + C5H11NO2 = (C5H10NO2+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 87.9 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; M |
By formula: C5H12NO2+ + C5H11NO2 = (C5H12NO2+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.6 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; M |
By formula: Na+ + C5H11NO2 = (Na+ • C5H11NO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 173. ± 13. | kJ/mol | IMRE | Gapeev and Dunbar, 2003 | Anchor glycine=38.5+-2.1; RCD |
ΔrH° | 173. | kJ/mol | CIDC | Kish, Ohanessian, et al., 2003 | Anchor alanine=39.89; RCD |
References
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, Ion clustering data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Ribeiro da Silva, Ribeiro da Silva, et al., 1992
Ribeiro da Silva, M.A.V.; Ribeiro da Silva, M.D.M.C.; Bernardo, M.M.C.; Santos, L.M.N.B.F.,
Thermochemistry of some metallic amino acid complexes. Part 1. Copper(II) complexes,
Thermochim. Acta, 1992, 205, 99-113. [all data]
Vasil'ev, Borodin, et al., 1991
Vasil'ev, V.P.; Borodin, V.A.; Kopnyshev, S.B.,
Standard enthalpies of formation of some amino acids,
Russ. J. Phys. Chem. (Engl. Transl.), 1991, 65, 1029. [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]
Badelin, Kulikov, et al., 1990
Badelin, V.G.; Kulikov, O.V.; Batagin, V.S.; Udzig, E.; Zielenkiewicz, A.; Zielenkiewicz, W.; Krestov, G.A.,
Physico-chemical properties of peptides and their solutions,
Thermochim. Acta, 1990, 169, 81-93. [all data]
Kulikov, Kozlov, et al., 1989
Kulikov, O.V.; Kozlov, V.A.; Malenkina, L.I.; Badelin, V.G.,
Heat capacities of amino acids and peptides and excess characteristics ot their aqueous solutions, Sbornik Nauch. Trud., Termodin. Rast. neelect., Ivanovo,
Inst. nevod. rast., 1989, Akad. [all data]
Gapeev and Dunbar, 2003
Gapeev, A.; Dunbar, R.C.,
Na+ Affinities of Gas-Phase Amino Acids by Ligand Exchange Equilibrium,
Int. J. Mass Spectrom., 2003, 228, 2-3, 825, https://doi.org/10.1016/S1387-3806(03)00242-2
. [all data]
Kish, Ohanessian, et al., 2003
Kish, M.M.; Ohanessian, G.; Wesdemiotis, C.,
The Na+ affinities of a-amino acids: side-chain substituent effects,
Int. J. Mass Spectrom., 2003, 227, 3, 509, https://doi.org/10.1016/S1387-3806(03)00082-4
. [all data]
Meot-Ner and Field, 1974
Meot-Ner, (Mautner); Field, F.H.,
Solvation and Association of Protonated Gaseous Amino Acids,
J. Am. Chem. Soc., 1974, 96, 10, 3168, https://doi.org/10.1021/ja00817a024
. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, Ion clustering data, References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°solid Enthalpy of formation 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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