3-bromo-4-chlorobenzotrifluoride (CAS 454-78-4) — formula C7H3BrClF3, molecular weight 259.45; category inorganic chemicals.
| CAS Number | 454-78-4 |
|---|---|
| Molecular Formula | C7H3BrClF3 |
| Molecular Weight | 259.45 |
| LogP | 4.4 |
| Category | Inorganic Chemicals |
3-bromo-4-chlorobenzotrifluoride is an inorganic compound with CAS registry number 454-78-4 and molecular formula C7H3BrClF3 (molecular weight 259.45), belonging to the inorganic chemicals segment of chemical raw materials.
CAS number: 454-78-4
Its molecular formula C7H3BrClF3 comprises 7 C, 3 H, 1 Br, 1 Cl, 3 F atoms.
Also known as: 3-bromo-4-chlorobenzotrifluoride · 3-溴-4-氯三氟化苯
Category: inorganic chemicals
The CAS registry number of 3-bromo-4-chlorobenzotrifluoride is 454-78-4.
Molecular formula C7H3BrClF3, molecular weight 259.45.
It is also registered under: 3-bromo-4-chlorobenzotrifluoride, 3-溴-4-氯三氟化苯.
Category: Inorganic Chemicals.
Independent reference data for 3-bromo-4-chlorobenzotrifluoride (CAS 454-78-4), compiled from public chemistry databases.
| CAS Registry Number | 454-78-4 |
|---|---|
| PubChem CID | 67988 |
| Molecular formula | C7H3BrClF3 |
| IUPAC name | 2-bromo-1-chloro-4-(trifluoromethyl)benzene |
| UNII (FDA) | ZP4MJL6EKM |
| Molecular Weight | 259.45 |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 257.90587 |
| Monoisotopic Mass | 257.90587 |
| Topological Polar Surface Area | 0 |
| Heavy Atom Count | 12 |
2-Bromo-1-chloro-4-(trifluoromethyl)benzene; EINECS 207-226-0; DTXSID80196495; APSISOSWYXCEQX-UHFFFAOYSA-; NSC 59728; RefChem:466057; DTXCID90118986; 207-226-0; InChI=1/C7H3BrClF3/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H; 454-78-4; 3-Bromo-4-chlorobenzotrifluoride; Benzene, 2-bromo-1-chloro-4-(trifluoromethyl)-; 3-Bromo-4-chloro-alpha,alpha,alpha-trifluorotoluene; MFCD00018093; 3-Bromo-4-chlorobenzotrifluoride, 97%; 1-bromo-2-chloro-5-trifluoromethylbenzene
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.7%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3-bromo-4-chlorobenzotrifluoride · CAS 454-78-4 · C7H3BrClF3. UNII ZP4MJL6EKM.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-溴-4-氯三氟化苯