Basic information
- Standard SMILES
O=C(c1ccc(Cl)c([N+](=O)[O-])c1)c1cc2ccccc2o1- InChIKey
BFEDQIKNSLCWKU-UHFFFAOYSA-N- Molecular formula
- C15H8ClNO4
- Average molar mass
- 301.68 g/mol
Names & identifiers
- Preferred name
- 2-(4-Chloro-3-nitrobenzoyl)-benzo[b]furan
- IUPAC
- 1-benzofuran-2-yl-(4-chloro-3-nitrophenyl)methanone
Names & synonyms
SCHEMBL11554040BFEDQIKNSLCWKU-UHFFFAOYSA-N2-(4-Chloro-3-nitrobenzoyl)-benzo[b]furan
Database identifiers
- PubChem CID
- 21316629
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 424
Related reactions
2 records
Compound notes
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