| Formula |
C5H4F3N3O |
| IUPAC Name |
2-amino-6-(trifluoromethyl)pyrimidin-1-ium-3-id-4-one |
| Molecular Mass |
179.100 g·mol−1 |
| Heat of Formation |
-655.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.29 ± 1.08 D |
| Volume |
170.09 Å 3 |
| Surface Area |
173.88 Å 2 |
| HOMO Energy |
-10.22 ± 0.55 eV |
| LUMO Energy |
-1.16 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-amino-4-hydroxy-6-(trifluoromethyl)pyrimidine
- 2-amino-4-hydroxy-6-trifluoromethylpyrimidine
- 2-amino-6-(trifluoromethyl)-1h-pyrimidin-4-one
- 2-amino-6-(trifluoromethyl)-4-pyrimidinol
|
| CAS Number(s) |
|
| InChIKey |
ZEPSVMLZBXDPGU-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
N
O
F
|
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