Phenyl 4-bromobenzoate
phenyl 4-bromobenzoate
Also Known As: phenyl 4-bromobenzoate|Phenyl p-bromobenzoate|4-Bromo-benzoic acid phenyl ester|Benzoic acid, 4-bromo-, phenyl ester|Benzoic acid, p-bromo-, phenyl ester|4-Bromobenzoic acid phenyl ester [MI]|4-Bromobenzoic acid, phenyl ester|benzoic acid,4-bromo-,phenyl ester|4-Bromobenzoic acid phenyl ester|BAS 00084433|J1.821.674D|F3098-8377
CAS: 5798-76-5
| Molecular Formula | C13H9BrO2 |
|---|---|
| Molecular Weight | 275.97858 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.97858 |
| Monoisotopic Mass | 275.97858 |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 5798-76-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)Br |
| InChIKey | GKOPHSXEQSIHQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (26 patents)
Organic Building Blocks (9 patents)
Pharmaceutical Intermediates (11 patents)
Polymer Intermediates (4 patents)
Product Overview
Phenyl 4-bromobenzoate (CAS 5798-76-5), with molecular formula C13H9BrO2 and molecular weight 275.97858 g/mol. IUPAC: phenyl 4-bromobenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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