Serine
- Formula: C3H7NO3
- Molecular weight: 105.0926
- IUPAC Standard InChIKey: MTCFGRXMJLQNBG-UWTATZPHSA-N
- CAS Registry Number: 56-45-1
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: L-Serine; Serine, L-; α-Amino-β-hydroxypropionic acid-, (S)-; β-Hydroxyalanine; L-(-)-Serine; Propanoic acid, 2-amino-3-hydroxy-, (S)-; 2-Amino-3-hydroxypropanoic acid-, (S)-; l-2-Amino-3-hydroxy-propanoic acid; (S)-(-)-Serine; 2-Amino-3-hydroxypropionic acid; 3-Hydroxyalanine; l-2-Amino-3-hydroxypropionic acid; (S)-2-Amino-3-hydroxypropanoic acid; (S)-Serine; L-Ser
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Gas phase ion energetics 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 evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
Data compiled as indicated in comments:
B - John E. Bartmess
MM - Michael M. Meot-Ner (Mautner)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 218.6 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 210.5 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Proton affinity at 298K
Proton affinity (kcal/mol) | Reference | Comment |
---|---|---|
216.2 ± 1.0 | Bouchoux and Salpin, 2003 | T = 298K; MM |
218.1 | Bojesen and Breindahl, 1994 | PA increased by 0.9 kcal/mol for referencing values to Hunter and Lias, 1998; MM |
Gas basicity at 298K
Gas basicity (review) (kcal/mol) | Reference | Comment |
---|---|---|
208.1 ± 1.0 | Bouchoux and Salpin, 2003 | T = 298K; MM |
De-protonation reactions
By formula: C3H6NO3- + H+ = C3H7NO3
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 332.5 ± 5.3 | kcal/mol | CIDC | Jones, Bernier, et al., 2007 | gas phase; B |
ΔrH° | 332.6 ± 3.1 | kcal/mol | G+TS | O'Hair, Bowie, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 325.8 ± 3.0 | kcal/mol | CIDC | O'Hair, Bowie, et al., 1992 | gas phase; B |
References
Go To: Top, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Bouchoux and Salpin, 2003
Bouchoux, G.; Salpin, J.Y.,
Gas-phase basicity of glycine, alanine, proline, serine, lysine, histidine and some of their peptides by the thermokinetic method,
European J. Mass Spectrometry, 2003, 9, 391-402. [all data]
Bojesen and Breindahl, 1994
Bojesen, G.; Breindahl, T.,
On the Proton Affinity od Some Alpha-Amino Acids and the Theory of the Kinetic Method.,
J. Chem. Soc. Perkin 2, 1994, 1029. [all data]
Jones, Bernier, et al., 2007
Jones, C.M.; Bernier, M.; Carson, E.; Colyer, K.E.; Metz, R.; Pawlow, A.; Wischow, E.D.; Webb, I.; Andriole, E.J.; Poutsma, J.C.,
Gas-phase Acities of the 20 Protein Amino Acids,
Int. J. Mass Spectrom., 2007, 267, 1-3, 54-62, https://doi.org/10.1016/j.ijms.2007.02.018
. [all data]
O'Hair, Bowie, et al., 1992
O'Hair, R.J.; Bowie, J.H.; Gronert, S.,
Gas Phase Acidity of the alpha-Amino Acids,
Int. J. Mass Spectrom. Ion Proc., 1992, 117, 23, https://doi.org/10.1016/0168-1176(92)80083-D
. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Symbols used in this document:
ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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