4,4,4-Trifluoro-1-butanol (CAS 461-18-7) — formula C4H7F3O, molecular weight 128.09; category organic chemicals.
4,4,4-Trifluoro-1-butanol is a carbon-based organic compound with CAS registry number 461-18-7 and molecular formula C4H7F3O (molecular weight 128.09), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 461-18-7
Its molecular formula C4H7F3O comprises 4 C, 7 H, 3 F, 1 O atoms.
Also known as: 4,4,4-Trifluoro-1-butanol · 4,4,4-trifluorobutanol
Category: organic chemicals
The CAS registry number of 4,4,4-Trifluoro-1-butanol is 461-18-7.
Molecular formula C4H7F3O, molecular weight 128.09.
It is also registered under: 4,4,4-Trifluoro-1-butanol, 4,4,4-trifluorobutanol.
Category: Organic Chemicals.
Public-database records for 4,4,4-Trifluoro-1-butanol (CAS 461-18-7), reproduced here for independent cross-checking.
| Reported hazard statements | H226 (100%), H302 (83.3%), H315 (16.7%), H319 (95.8%), H335 (14.6%) |
|---|
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
H302 (83.3%): Harmful if swallowed [Warning Acute toxicity, oral]
| LogP | 0.9 |
|---|
| CAS Registry Number | 461-18-7 |
|---|---|
| PubChem CID | 136307 |
| 分子式 | C4H7F3O |
| IUPAC 名称 | 4,4,4-trifluorobutan-1-ol |
| UNII（FDA） | NS00134713 |
4,4,4-Trifluoro-1-butanol; 4,4,4-trifluorobutan-1-ol; RefChem:506981; 610-282-2; 461-18-7; 4,4,4-Trifluorobutanol; 4,4,4-trifluoro-butan-1-ol; 4,4,4-trifluorobutanol-1; MFCD00041483; 1-BUTANOL, 4,4,4-TRIFLUORO-; SCHEMBL79029; 4,4,4-Trifluoro-1-butanol #; DTXSID40196714; SB40515; EN300-63962; 4,4,4-Trifluorobutane-1-ol
| 分子量 | 128.09 |
|---|---|
| XLogP3 | 0.9 |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 2 |
| 精确质量 | 128.04489933 |
| 单同位素质量 | 128.04489933 |
| 拓扑极性表面积 | 20.2 |
| 重原子数 | 8 |
| 形式电荷 | 0 |
4,4,4-Trifluoro-1-butanol · CAS 461-18-7 · C4H7F3O. UNII NS00134713. LogP: 0.9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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