Basic information
- CAS
84447-83-6- Standard SMILES
O=C(CBr)c1ccc(Oc2ccc(Cl)cc2)cc1- InChIKey
ORXLVGIZIGVHGE-UHFFFAOYSA-N- Molecular formula
- C14H10BrClO2
- Average molar mass
- 325.58 g/mol
- Monoisotopic mass
- 323.95527
Names & identifiers
- Preferred name
- 2-Bromo-1-(4-(4-chlorophenoxy)phenyl)ethan-1-one
- IUPAC
- 2-bromo-1-[4-(4-chlorophenoxy)phenyl]ethanone
Names & synonyms
84447-83-62-bromo-1-[4-(4-chlorophenoxy)phenyl]ethan-1-one2-Bromo-1-(4-(4-chlorophenoxy)phenyl)ethan-1-oneRefChem:465941819-311-52-Bromo-1-[4-(4-chlorophenoxy)phenyl]ethanoneMFCD09759113SCHEMBL1283602AKOS015995793DB-089795EN300-342501
Database identifiers
- CAS
84447-83-6- PubChem CID
- 13072012
- EC Number
- 819-311-5
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 269
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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