3-fluoro-4-(trifluoromethyl)benzoic acid (CAS 115754-21-7) — formula C8H4F4O2, molecular weight 208.11; category organic chemicals.
| CAS Number | 115754-21-7 |
|---|---|
| Molecular Formula | C8H4F4O2 |
| Molecular Weight | 208.11 |
| LogP | 2.4 |
| Category | Organic Chemicals |
3-fluoro-4-(trifluoromethyl)benzoic acid is a carbon-based organic compound with CAS registry number 115754-21-7 and molecular formula C8H4F4O2 (molecular weight 208.11), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 115754-21-7
Its molecular formula C8H4F4O2 comprises 8 C, 4 H, 4 F, 2 O atoms.
Also known as: 3-fluoro-4-(trifluoromethyl)benzoic acid · 3-氟-4-(三氟甲基)苯甲酸
Category: organic chemicals
The CAS registry number of 3-fluoro-4-(trifluoromethyl)benzoic acid is 115754-21-7.
Molecular formula C8H4F4O2, molecular weight 208.11.
It is also registered under: 3-fluoro-4-(trifluoromethyl)benzoic acid, 3-氟-4-(三氟甲基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-fluoro-4-(trifluoromethyl)benzoic acid (CAS 115754-21-7), compiled from public chemistry databases.
| CAS Registry Number | 115754-21-7 |
|---|---|
| PubChem CID | 688293 |
| Molecular formula | C8H4F4O2 |
| IUPAC name | 3-fluoro-4-(trifluoromethyl)benzoic acid |
| UNII (FDA) | ST50307527 |
| 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 |
3-Fluoro-4-(trifluoromethyl)benzoic acid; 115754-21-7; DTXSID30350863; RefChem:279406; DTXCID70301930; 624-783-9; Benzoic acid, 3-fluoro-4-(trifluoromethyl)-; MFCD00236279; 3-fluoro-4-trifluoromethylbenzoic acid; SCHEMBL850429; AKOS005063815; AC-3991; 3-Fluoro-4(trifluoromethyl)benzoic acid; SY018909; EN300-109451; Z1269175952
| 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-fluoro-4-(trifluoromethyl)benzoic acid · CAS 115754-21-7 · C8H4F4O2. UNII ST50307527.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氟-4-(三氟甲基)苯甲酸