3-(5-Bromo-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-L-Alanine
Properties
Property | Value |
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Formula | C7H8BrN3O4 |
IUPAC Name | (2s)-2-amino-3-(5-bromo-2,4-dioxo-pyrimidin-1-yl)propanoic acid |
Molecular Mass | 278.060 g·mol−1 |
Heat of Formation | -642.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.76 ± 1.08 D |
Volume | 245.99 Å 3 |
Surface Area | 225.57 Å 2 |
HOMO Energy | -9.57 ± 0.55 eV |
LUMO Energy | 2.02 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | AEKIJKSVXKWGRJ-BYPYZUCNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Br N |