Formula |
C7H9N3O4 |
IUPAC Name |
(2s)-2-amino-3-(2,4-dioxo-1h-pyrimidin-3-yl)propanoic acid |
Molecular Mass |
199.164 g·mol−1 |
Heat of Formation |
-672.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.87 ± 1.08 D |
Volume |
216.14 Å 3 |
Surface Area |
199.86 Å 2 |
HOMO Energy |
-10.02 ± 0.55 eV |
LUMO Energy |
2.35 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-amino-3-(2,6-diketo-3h-pyrimidin-1-yl)propionic acid
- (2s)-2-amino-3-(2,6-dioxo-3h-pyrimidin-1-yl)propanoic acid
- beta-(2,4-dihydroxypyrimidin-3-yl)alanine
- isowillardiine
|
CAS Number(s) |
|
InChIKey |
AZSWUZQIIMMKOZ-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
N
|
|
|