| Formula |
C12H13F3N4O4PS- |
| IUPAC Name |
2-[3-[[4-amino-2-(trifluoromethyl)pyrimidin-5-yl]methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphate |
| Molecular Mass |
397.290 g·mol−1 |
| Heat of Formation |
314.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
11.02 ± 1.08 D |
| Volume |
373.99 Å 3 |
| Surface Area |
361.12 Å 2 |
| HOMO Energy |
-9.84 ± 0.55 eV |
| LUMO Energy |
-2.56 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[3-[[4-amino-2-(trifluoromethyl)-5-pyrimidinyl]methyl]-4-methyl-5-thiazol-3-iumyl]ethyl phosphate
- 2-[3-[[4-amino-2-(trifluoromethyl)pyrimidin-5-yl]methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphate
- 2-[3-[[4-amino-2-(trifluoromethyl)pyrimidin-5-yl]methyl]-4-methyl-thiazol-3-ium-5-yl]ethyl phosphate
- 3-(4-amino-2-trifluoromethyl-pyrimidin-5-ylmethyl)-4-methyl-5-(2-phosphonatooxy-ethyl)-thiazol-3-ium
- ftp
- trifluoro-thiamin phosphate
|
| InChIKey |
ZIBIECXVPMYJCV-UHFFFAOYSA-M |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
C
F
O
N
P
S
|
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