Benzene-1,2-diylbis[(3,5-dibromo-4-methoxyphenyl)methanone]
Basic information
- CAS
5452-93-7- Standard SMILES
COc1c(Br)cc(C(=O)c2ccccc2C(=O)c2cc(Br)c(OC)c(Br)c2)cc1Br- InChIKey
RSJJRCSTMYOQMC-UHFFFAOYSA-N- Molecular formula
- C22H14Br4O4
- Average molar mass
- 662 g/mol
- Monoisotopic mass
- 657.76256
Names & identifiers
- Preferred name
- Benzene-1,2-diylbis[(3,5-dibromo-4-methoxyphenyl)methanone]
- IUPAC
- [2-(3,5-dibromo-4-methoxybenzoyl)phenyl]-(3,5-dibromo-4-methoxyphenyl)methanone
Names & synonyms
5452-93-7benzene-1,2-diylbis[(3,5-dibromo-4-methoxyphenyl)methanone]NSC19019DTXSID80280904NSC-19019(1,2-Phenylene)bis[(3,5-dibromo-4-methoxyphenyl)methanone]
Database identifiers
- CAS
5452-93-7- PubChem CID
- 227440
- DTXSID
DTXSID80280904
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 542
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Compound notes
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