Basic information
- Standard SMILES
BrCc1ccc(-c2ccc(-c3c(Cc4ccccc4)oc4ccccc34)cc2)cc1- InChIKey
XOPCWHGZQUJFQV-UHFFFAOYSA-N- Molecular formula
- C28H21BrO
- Average molar mass
- 453.4 g/mol
- Monoisotopic mass
- 452.07758
Names & identifiers
- Preferred name
- 2-Benzyl-3-(4'-bromomethylbiphen-4-yl)benzofuran
- IUPAC
- 2-benzyl-3-[4-[4-(bromomethyl)phenyl]phenyl]-1-benzofuran
Names & synonyms
SCHEMBL13888092XOPCWHGZQUJFQV-UHFFFAOYSA-N2-Benzyl-3-(4'-bromomethylbiphen-4-yl)benzofuran
Database identifiers
- PubChem CID
- 59696178
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 513
Related reactions
6 records
Compound notes
Loading…