Methyl 3-bromo-4-(trifluoromethyl)benzoate (CAS 455941-82-9) — formula C9H6BrF3O2, molecular weight 283.04; category organic chemicals.
| CAS Number | 455941-82-9 |
|---|---|
| Molecular Formula | C9H6BrF3O2 |
| Molecular Weight | 283.04 |
| LogP | 3.4 |
| Category | Organic Chemicals |
Methyl 3-bromo-4-(trifluoromethyl)benzoate is a carbon-based organic compound with CAS registry number 455941-82-9 and molecular formula C9H6BrF3O2 (molecular weight 283.04), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 455941-82-9
Its molecular formula C9H6BrF3O2 comprises 9 C, 6 H, 1 Br, 3 F, 2 O atoms.
Also known as: Methyl 3-bromo-4-(trifluoromethyl)benzoate · 3-溴-4-(三氟甲基)苯甲酸甲酯
Category: organic chemicals
The CAS registry number of Methyl 3-bromo-4-(trifluoromethyl)benzoate is 455941-82-9.
Molecular formula C9H6BrF3O2, molecular weight 283.04.
It is also registered under: Methyl 3-bromo-4-(trifluoromethyl)benzoate, 3-溴-4-(三氟甲基)苯甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for Methyl 3-bromo-4-(trifluoromethyl)benzoate (CAS 455941-82-9), compiled from public chemistry databases.
| CAS Registry Number | 455941-82-9 |
|---|---|
| PubChem CID | 10924040 |
| Molecular formula | C9H6BrF3O2 |
| IUPAC name | methyl 3-bromo-4-(trifluoromethyl)benzoate |
| UNII (FDA) | BDBM600930 |
| Molecular Weight | 283.04 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 281.95033 |
| Monoisotopic Mass | 281.95033 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
Methyl 3-bromo-4-(trifluoromethyl)benzoate; 455941-82-9; DTXSID60448545; RefChem:354892; DTXCID60399366; 812-885-8; MFCD14697998; METHYL 3-BROMO-4-TRIFLUOROMETHYLBENZOATE; Methyl3-Bromo-4-(trifluoromethyl)benzoate; CL8931; SCHEMBL15392523; BDBM600930; US11634391, Compound 181; CHEMBL6041330; SCHEMBL29654055; AKOS016002708
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
Methyl 3-bromo-4-(trifluoromethyl)benzoate · CAS 455941-82-9 · C9H6BrF3O2. UNII BDBM600930.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-溴-4-(三氟甲基)苯甲酸甲酯