3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid (CAS 129931-45-9) — formula C8H3ClF4O2, molecular weight 242.55; category organic chemicals.
| CAS Number | 129931-45-9 |
|---|---|
| Molecular Formula | C8H3ClF4O2 |
| Molecular Weight | 242.55 |
| LogP | 3.1 |
| Category | Organic Chemicals |
3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid is a carbon-based organic compound with CAS registry number 129931-45-9 and molecular formula C8H3ClF4O2 (molecular weight 242.55), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 129931-45-9
Its molecular formula C8H3ClF4O2 comprises 8 C, 3 H, 1 Cl, 4 F, 2 O atoms.
Also known as: 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid · 3-氯-2-氟-5-(三氟甲基)苯甲酸
Category: organic chemicals
The CAS registry number of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid is 129931-45-9.
Molecular formula C8H3ClF4O2, molecular weight 242.55.
It is also registered under: 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid, 3-氯-2-氟-5-(三氟甲基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid (CAS 129931-45-9), compiled from public chemistry databases.
| CAS Registry Number | 129931-45-9 |
|---|---|
| PubChem CID | 2773751 |
| Molecular formula | C8H3ClF4O2 |
| IUPAC name | 3-chloro-2-fluoro-5-(trifluoromethyl)benzoic acid |
| UNII (FDA) | ST50407404 |
| Molecular Weight | 242.55 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 241.9757697 |
| Monoisotopic Mass | 241.9757697 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 15 |
3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid; 129931-45-9; DTXSID10378686; RefChem:278151; DTXCID50329713; 630-212-4; MFCD01631509; Benzoic acid, 3-chloro-2-fluoro-5-(trifluoromethyl)-; SCHEMBL43365; 3-CHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)BENZOICACID; SBB064307; AKOS005257761; AC-3934; PS-7551; 3-carboxy-5-chloro-4-fluorobenzotrifluoride, 5-chloro-alpha,alpha,alpha,6-tetrafluoro-m-toluic acid; SY106436
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3-Chloro-2-fluoro-5-(trifluoromethyl)benzoic acid · CAS 129931-45-9 · C8H3ClF4O2. UNII ST50407404.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氯-2-氟-5-(三氟甲基)苯甲酸