2-(3,5-双三氟甲基苯基)-2-甲基丙酸(CAS 289686-70-0):分子式 C12H10F6O2、分子量 300.20。
| CAS号 | 289686-70-0 |
|---|---|
| 分子式 | C12H10F6O2 |
| 分子量 | 300.20 |
| LogP | 4.1 |
2-(3,5-双三氟甲基苯基)-2-甲基丙酸 是一种化工化合物,登记 CAS 号为 289686-70-0,分子式 C12H10F6O2(分子量 300.20)。
登记 CAS 号:289686-70-0
其分子式 C12H10F6O2 由 12 个碳、10 个氢、6 个氟、2 个氧 组成。
别名/同义词:2-(3,5-双三氟甲基苯基)-2-甲基丙酸 · 2-(3,5-Bis-trifluoromethyl-phenyl)-2-methyl-propionic acid
2-(3,5-双三氟甲基苯基)-2-甲基丙酸 的 CAS 登记号为 289686-70-0。
分子式 C12H10F6O2,分子量 300.20。
别名/同义词:2-(3,5-双三氟甲基苯基)-2-甲基丙酸、2-(3,5-Bis-trifluoromethyl-phenyl)-2-methyl-propionic acid。
2-(3,5-双三氟甲基苯基)-2-甲基丙酸(CAS 289686-70-0)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 289686-70-0 |
|---|---|
| PubChem CID | 9835948 |
| Molecular formula | C12H10F6O2 |
| IUPAC name | 2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoic acid |
| UNII (FDA) | PKP3C83NLW |
| Molecular Weight | 300.20 |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 300.05849853 |
| Monoisotopic Mass | 300.05849853 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 20 |
289686-70-0; 2-(3,5-bis(trifluoromethyl)phenyl)-2-methylpropanoic acid; 2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoic acid; DTXSID70431524; RefChem:251258; DTXCID20382355; 690-867-7; MFCD09032572; Benzeneacetic acid, alpha,alpha-dimethyl-3,5-bis(trifluoromethyl)-; 2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropionic acid; 2-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-propanoic Acid; 2-(3,5-Bis(trifluoromethyl)phenyl)-2-methylpropionic acid; alpha,alpha-Dimethyl-3,5-bis(trifluoromethyl)benzeneacetic Acid; Netupitant ITS-5; 2-(3,5-Bis-trifluoromethyl-phenyl)-2-methyl-propionic acid; PKP3C83NLW
| GHS notification summary | 66.7% (2 / 3) |
|---|
| GHS notification summary | 66.7% (2 / 3) |
|---|---|
| Reported hazard statements | H302 (33.3%), H315 (33.3%), H319 (33.3%), H335 (33.3%) |
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]
2-(3,5-Bis-trifluoromethyl-phenyl)-2-methyl-propionic acid · CAS 289686-70-0 · C12H10F6O2. UNII PKP3C83NLW.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 2-(3,5-Bis-trifluoromethyl-phenyl)-2-methyl-propionic acid