5-fluoro-2-(trifluoromethyl)benzoic acid (CAS 654-99-9) — formula C8H4F4O2, molecular weight 208.11; category organic chemicals.
| CAS Number | 654-99-9 |
|---|---|
| Molecular Formula | C8H4F4O2 |
| Molecular Weight | 208.11 |
| LogP | 2.4 |
| Category | Organic Chemicals |
5-fluoro-2-(trifluoromethyl)benzoic acid is a carbon-based organic compound with CAS registry number 654-99-9 and molecular formula C8H4F4O2 (molecular weight 208.11), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 654-99-9
Its molecular formula C8H4F4O2 comprises 8 C, 4 H, 4 F, 2 O atoms.
Also known as: 5-fluoro-2-(trifluoromethyl)benzoic acid · 5-氟-2-(三氟甲基)苯甲酸
Category: organic chemicals
The CAS registry number of 5-fluoro-2-(trifluoromethyl)benzoic acid is 654-99-9.
Molecular formula C8H4F4O2, molecular weight 208.11.
It is also registered under: 5-fluoro-2-(trifluoromethyl)benzoic acid, 5-氟-2-(三氟甲基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 5-fluoro-2-(trifluoromethyl)benzoic acid (CAS 654-99-9), compiled from public chemistry databases.
| CAS Registry Number | 654-99-9 |
|---|---|
| PubChem CID | 688294 |
| Molecular formula | C8H4F4O2 |
| IUPAC name | 5-fluoro-2-(trifluoromethyl)benzoic acid |
| UNII (FDA) | ST50319731 |
| Molecular Weight | 208.11 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 208.01474201 |
| Monoisotopic Mass | 208.01474201 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 14 |
5-Fluoro-2-(trifluoromethyl)benzoic acid; 654-99-9; DTXSID90350864; RefChem:303130; DTXCID30301931; 626-221-8; MFCD00083521; 2-trifluoromethyl-5-fluorobenzoic acid; 5-fluoro-2-trifluoromethylbenzoic acid; alpha,alpha,alpha,5-Tetrafluoro-o-toluic acid; SCHEMBL222474; SCHEMBL29406303; CK2235; SBB064470; AKOS005067841; 3-Fluoro-6-trifluoromethylbenzoic acid
| 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]
5-fluoro-2-(trifluoromethyl)benzoic acid · CAS 654-99-9 · C8H4F4O2. UNII ST50319731.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氟-2-(三氟甲基)苯甲酸