1-Propanol, 3-amino-
- Formula: C3H9NO
- Molecular weight: 75.1097
- IUPAC Standard InChIKey: WUGQZFFCHPXWKQ-UHFFFAOYSA-N
- CAS Registry Number: 156-87-6
- 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: β-Alaninol; γ-Aminopropanol; Propanolamine; 1-Amino-3-propanol; 3-Amino-1-propanol; 3-Aminopropyl alcohol; 3-Hydroxypropylamine; 3-Propanolamine; NH2(CH2)3OH; 3-Aminopropanol; 3-Aminopropanol-(1); 1-Amino-3-hydroxypropane; 1,3-Propanolamine; 3-Hydroxy-1-aminopropane; 3-Hydroxy-1-propylamine; NSC 7766; 3-aminopropan-1-ol
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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:
MM - Michael M. Meot-Ner (Mautner)
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
View reactions leading to C3H9NO+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 962.5 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 917.3 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Proton affinity at 298K
Proton affinity (kJ/mol) | Reference | Comment |
---|---|---|
>945.3 | Bouchoux, Buisson, et al., 2003 | MM |
>936.0 | Bouchoux, Buisson, et al., 2003 | MM |
>953.5 ± 1.6 | Bouchoux, Buisson, et al., 2003 | MM |
Gas basicity at 298K
Gas basicity (review) (kJ/mol) | Reference | Comment |
---|---|---|
912.5 | Bouchoux, Buisson, et al., 2003 | MM |
903.8 | Bouchoux, Buisson, et al., 2003 | MM |
921.3 ± 1.2 | Bouchoux, Buisson, et al., 2003 | MM |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.0 | PE | Leavell, Steichen, et al., 1973 | LLK |
9.77 ± 0.20 | PE | Leavell, Steichen, et al., 1973 | Vertical value; LLK |
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, Buisson, et al., 2003
Bouchoux, G.; Buisson, D.A.; Bourcier, S.; Sablier, M.,
Application of the kinetic method to bifunctional bases. ESI tandem quadrupole experiments,
Int. J. Mass Spectrom., 2003, 228, 1035. [all data]
Leavell, Steichen, et al., 1973
Leavell, S.; Steichen, J.; Franklin, J.L.,
Photoelectron spectra of intramolecularly hydrogen bonded compounds,
J. Chem. Phys., 1973, 59, 4343. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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