Basic information
- CAS
307507-73-9- Standard SMILES
Cc1cc(Cl)ccc1OC(=O)c1cccc(Br)c1- InChIKey
OGZJHMOIOSTWSX-UHFFFAOYSA-N- Molecular formula
- C14H10BrClO2
- Average molar mass
- 325.58 g/mol
- Monoisotopic mass
- 323.95527
Names & identifiers
- Preferred name
- 4-Chloro-2-methylphenyl 3-bromobenzoate
- IUPAC
- (4-chloro-2-methylphenyl) 3-bromobenzoate
- English name
- 4-chloro-2-methylphenyl 3-bromobenzoate
- Molecular formula
- C14H10BrClO2
- Molecular weight
- 325.58
Names & synonyms
4-chloro-2-methylphenyl 3-bromobenzoate(4-chloro-2-methylphenyl) 3-bromobenzoateOGZJHMOIOSTWSX-UHFFFAOYSA-NAKOS002264736307507-73-9ST030319AP-906/409281143-Bromobenzoic acid, 4-chloro-2-methylphenyl esterF3284-1159Benzoic acid, 3-bromo-, 4-chloro-2-methylphenyl ester
Database identifiers
- CAS
307507-73-9- PubChem CID
- 727614
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Physicochemical properties
- Boiling point
- 452.3 · 452.3±45.0 °C(Predicted)
- Density
- 1.498 · 1.498±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
OTAVA-BB[email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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