α,α,α-三氟间甲基苯甲酸，CAS 登记号 454-92-2，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于有机化学品。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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Alpha,Alpha,Alpha-Trifluoro-m-toluic acid · CAS 454-92-2 · C8H5F3O2. UNII 930H336M90. LogP: 2.95; Ionization Efficiency: 1.16; Ionization Efficiency: 10.5.
| CAS Registry Number | 454-92-2 |
|---|---|
| PubChem CID | 9963 |
| Molecular formula | C8H5F3O2 |
| IUPAC name | 3-(trifluoromethyl)benzoic acid |
| UNII (FDA) | 930H336M90 |
| Molecular Weight | 190.12 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 190.02416388 |
| Monoisotopic Mass | 190.02416388 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| LogP | 2.95 |
|---|---|
| Ionization Efficiency | 1.16 |
| Ionization Efficiency | 10.5 |
| Ionization Efficiency | MeCN (80%) |
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.9%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3-(Trifluoromethyl)benzoic acid; 454-92-2; Benzoic acid, 3-(trifluoromethyl)-; 3-TRIFLUOROMETHYLBENZOIC ACID; alpha,alpha,alpha-Trifluoro-m-toluic acid; m-(Trifluoromethyl)benzoic acid; 3-Trifluoromethylbenzoate; DTXSID2041460; 3-TFMBA; NSC-43025; 930H336M90; DTXCID0021460; CHEBI:60695; m-Toluic acid, alpha,alpha,alpha-trifluoro-; RefChem:496375; meta-trifluoromethylbenzoate
CAS 454-92-2; molecular formula C8H5F3O2; molecular weight — g/mol.
3-(Trifluoromethyl)benzoic acid, 454-92-2, Benzoic acid, 3-(trifluoromethyl)-, 3-TRIFLUOROMETHYLBENZOIC ACID, alpha,alpha,alpha-Trifluoro-m-toluic acid, m-(Trifluoromethyl)benzoic acid.
Hazard statements reported: H315, H319, H335.
LogP: 2.95; Ionization Efficiency: 1.16; Ionization Efficiency: 10.5; Ionization Efficiency: MeCN (80%).
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.