Basic information
- CAS
114467-75-3- Standard SMILES
FC(F)(Br)c1ccc(Cl)cc1- InChIKey
UUAHGNFKMHMRDY-UHFFFAOYSA-N- Molecular formula
- C7H4BrClF2
- Average molar mass
- 241.46 g/mol
- Monoisotopic mass
- 239.9153
Names & identifiers
- Preferred name
- 1-(Bromodifluoromethyl)-4-chlorobenzene
- IUPAC
- 1-[bromo(difluoro)methyl]-4-chlorobenzene
- English name
- 4-(BroModifluoroMethyl)chlorobenzene
- Molecular formula
- C7H4BrClF2
- Molecular weight
- 241.46
Names & synonyms
114467-75-31-(bromodifluoromethyl)-4-chlorobenzeneRefChem:427162819-163-14-(Bromodifluoromethyl)chlorobenzene1-[bromo(difluoro)methyl]-4-chlorobenzeneSCHEMBL12869567UUAHGNFKMHMRDY-UHFFFAOYSA-NPEA46775MFCD22988900AKOS033752162benzene, 1-(bromodifluoromethyl)-4-chloro-
Show more names
DB-252809EN300-209503Z1618035377InChI=1/C7H4BrClF2/c8-7(10,11)5-1-3-6(9)4-2-5/h1-4
Database identifiers
- CAS
114467-75-3- PubChem CID
- 640458
- EC Number
- 819-163-1
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Boiling point
- 95 °C · 95 °C(Press: 20 Torr)
- Density
- 1.692 · 1.692±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H315-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319-H315-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers4 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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