| Formula |
C10H12N2O5 |
| IUPAC Name |
methyl (2s)-2-amino-3-(4-hydroxy-3-nitro-phenyl)propanoate |
| Molecular Mass |
240.213 g·mol−1 |
| Heat of Formation |
-491.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.51 ± 1.08 D |
| Volume |
269.58 Å 3 |
| Surface Area |
251.93 Å 2 |
| HOMO Energy |
-9.73 ± 0.55 eV |
| LUMO Energy |
-1.47 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-[(2s)-2-ammonio-3-keto-3-methoxy-propyl]-2-nitro-phenolate
- 4-[(2s)-2-ammonio-3-methoxy-3-oxopropyl]-2-nitrophenolate
- 4-[(2s)-2-azaniumyl-3-methoxy-3-oxo-propyl]-2-nitro-phenolate
- 4-[(2s)-2-azaniumyl-3-methoxy-3-oxopropyl]-2-nitrophenolate
|
| CAS Number(s) |
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| InChIKey |
WMZFQRWZCGEEOA-ZETCQYMHSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
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