Basic information
- CAS
88952-04-9- Standard SMILES
COc1ccccc1C(=O)Oc1ccc(Br)cc1C(C)=O- InChIKey
QDHCPQWLSGSTFK-UHFFFAOYSA-N- Molecular formula
- C16H13BrO4
- Average molar mass
- 349.17 g/mol
- Monoisotopic mass
- 347.99972
Names & identifiers
- Preferred name
- 2-Acetyl-4-bromophenyl 2-methoxybenzoate
- IUPAC
- (2-acetyl-4-bromophenyl) 2-methoxybenzoate
Names & synonyms
88952-04-92-Acetyl-4-bromophenyl 2-methoxybenzoateDTXSID80526011
Database identifiers
- CAS
88952-04-9- PubChem CID
- 13190810
- DTXSID
DTXSID80526011
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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