Voriconazole (CAS 137234-62-9) — formula C16H14F3N5O, molecular weight 349.31; category organic chemicals.
Voriconazole is a carbon-based organic compound with CAS registry number 137234-62-9 and molecular formula C16H14F3N5O (molecular weight 349.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 137234-62-9
Its molecular formula C16H14F3N5O comprises 16 C, 14 H, 3 F, 5 N, 1 O atoms.
Also known as: Voriconazole
Category: organic chemicals
The CAS registry number of Voriconazole is 137234-62-9.
Molecular formula C16H14F3N5O, molecular weight 349.31.
It is also registered under: Voriconazole.
Category: Organic Chemicals.
Public-database records for Voriconazole (CAS 137234-62-9), reproduced here for independent cross-checking.
| Reported hazard statements | H301 (99.2%), H351 (93.2%), H360 (32.2%), H361 (66.9%), H373 (97.5%), H400 (23.7%), H410 (23.7%), H412 (96.6%) |
|---|
H301 (99.2%): Toxic if swallowed [Danger Acute toxicity, oral]
H351 (93.2%): Suspected of causing cancer [Warning Carcinogenicity]
| 熔点 | 134 |
|---|---|
| 熔点 | 127 - 130 °C |
| 溶解度 | 9.78e-02 g/L |
| LogP | 1.7 |
| CAS Registry Number | 137234-62-9 |
|---|---|
| PubChem CID | 71616 |
| 分子式 | C16H14F3N5O |
| IUPAC 名称 | (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol |
| UNII(FDA) | JFU09I87TR |
Voriconazole; 137234-62-9; Vfend; (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol; UK-109496; Voriconazol; (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol; Voriconazolum; UK-109,496; UK 109496; JFU09I87TR; NSC-759888; DTXSID5046485; CHEBI:10023; DTXCID3026485; UK109496
| 分子量 | 349.31 |
|---|---|
| XLogP3 | 1.5 |
| 氢键供体数 | 1 |
| 氢键受体数 | 8 |
| 可旋转键数 | 5 |
| 精确质量 | 349.11504457 |
| 单同位素质量 | 349.11504457 |
| 拓扑极性表面积 | 76.7 |
| 重原子数 | 25 |
| 形式电荷 | 0 |
Voriconazole · CAS 137234-62-9 · C16H14F3N5O. UNII JFU09I87TR. 熔点: 134; 熔点: 127 - 130 °C; 溶解度: 9.78e-02 g/L.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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