Formula |
C6H8N2O4 |
IUPAC Name |
(2s)-2-amino-3-[(2r)-5-oxoisoxazol-2-yl]propanoic acid |
Molecular Mass |
172.139 g·mol−1 |
Heat of Formation |
-466.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.45 ± 1.08 D |
Volume |
190.96 Å 3 |
Surface Area |
190.29 Å 2 |
HOMO Energy |
-9.97 ± 0.55 eV |
LUMO Energy |
-0.83 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-amino-3-(5-ketoisoxazol-2-yl)propionic acid
- (2s)-2-amino-3-(5-oxo-1,2-oxazol-2-yl)propanoic acid
- (2s)-2-amino-3-(5-oxo-2-isoxazolyl)propanoic acid
- (2s)-2-amino-3-(5-oxoisoxazol-2-yl)propanoic acid
- (isoxazolin-5-on-2-yl)alanine
- (s)-alpha-amino-5-oxo-2(5h)-isoxazolepropanoic acid
- 2(5h)-isoxazolepropanoic acid, alpha-amino-5-oxo-, (s)-
- beta-(isoxazolin-5-on-2-yl)alanine
- bioya
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CAS Number(s) |
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InChIKey |
BDHFFHBFJUZSBF-BYPYZUCNSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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