3-[o-(α,α,α-trifluorotolyl)]propionic acid (CAS 94022-99-8) — formula C10H9F3O2, molecular weight 218.17; category organic chemicals.
| CAS Number | 94022-99-8 |
|---|---|
| Molecular Formula | C10H9F3O2 |
| Molecular Weight | 218.17 |
| LogP | 2.6 |
| Category | Organic Chemicals |
3-[o-(α,α,α-trifluorotolyl)]propionic acid is a carbon-based organic compound with CAS registry number 94022-99-8 and molecular formula C10H9F3O2 (molecular weight 218.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94022-99-8
Its molecular formula C10H9F3O2 comprises 10 C, 9 H, 3 F, 2 O atoms.
Also known as: 3-[o-(α,α,α-trifluorotolyl)]propionic acid · 3-[邻-(α,α,α-三氟甲苯基)]丙酸
Category: organic chemicals
The CAS registry number of 3-[o-(α,α,α-trifluorotolyl)]propionic acid is 94022-99-8.
Molecular formula C10H9F3O2, molecular weight 218.17.
It is also registered under: 3-[o-(α,α,α-trifluorotolyl)]propionic acid, 3-[邻-(α,α,α-三氟甲苯基)]丙酸.
Category: Organic Chemicals.
Independent reference data for 3-[o-(α,α,α-trifluorotolyl)]propionic acid (CAS 94022-99-8), compiled from public chemistry databases.
| CAS Registry Number | 94022-99-8 |
|---|---|
| PubChem CID | 15284809 |
| Molecular formula | C10H9F3O2 |
| IUPAC name | 3-[2-(trifluoromethyl)phenyl]propanoic acid |
| UNII (FDA) | Z317037938 |
| Molecular Weight | 218.17 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 218.05546401 |
| Monoisotopic Mass | 218.05546401 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 15 |
2-(Trifluoromethyl)benzenepropanoic acid; RefChem:462547; 94022-99-8; 3-[2-(Trifluoromethyl)phenyl]propanoic acid; 3-[2-(trifluoromethyl)phenyl]propionic acid; 3-(2-(trifluoromethyl)phenyl)propanoic acid; MFCD06823965; 3-[o-(alpha,alpha,alpha-trifluorotolyl)]propionic acid; 2-(trifluoromethyl)hydrocinnamic acid; Cinacalcet Impurity 52; CHEBI:60707; AKOS000197401; SY032237; Z317037938; Benzenepropanoic acid, 2-(trifluoromethyl)-; 3-[2-(Trifluoromethyl)phenyl]propanoicacid
| Reported hazard statements | H302 (91.3%), H315 (97.8%), H319 (97.8%), H335 (97.8%) |
|---|
H302 (91.3%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation]
3-[o-(α,α,α-trifluorotolyl)]propionic acid · CAS 94022-99-8 · C10H9F3O2. UNII Z317037938.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-[邻-(α,α,α-三氟甲苯基)]丙酸