3-(3,4-Dioxo-1,5-Cyclohexadien-1-Yl)-L-Alanine
Properties
Property | Value |
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Formula | C9H9NO4 |
IUPAC Name | (2s)-2-amino-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)propanoic acid |
Molecular Mass | 195.172 g·mol−1 |
Heat of Formation | -497.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.30 ± 1.08 D |
Volume | 225.51 Å 3 |
Surface Area | 209.71 Å 2 |
HOMO Energy | -9.96 ± 0.55 eV |
LUMO Energy | -1.94 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | AHMIDUVKSGCHAU-LURJTMIESA-N |
QR Code | Generate QR Code |
Links | PubChem Wikipedia ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |