3-(4-Chlorophenyl)benzo[f][1,2]benzoxazole-4,9-dione
Basic information
- CAS
38079-04-8- Standard SMILES
O=C1c2ccccc2C(=O)c2c(-c3ccc(Cl)cc3)noc21- InChIKey
GXMDSHKAXNHJLD-UHFFFAOYSA-N- Molecular formula
- C17H8ClNO3
- Average molar mass
- 309.7 g/mol
- Monoisotopic mass
- 309.0192708
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)benzo[f][1,2]benzoxazole-4,9-dione
- IUPAC
- 3-(4-chlorophenyl)benzo[f][1,2]benzoxazole-4,9-dione
Names & synonyms
NSC3604963-(4-chlorophenyl)benzo[f][1,2]benzoxazole-4,9-dione
Database identifiers
- CAS
38079-04-8- PubChem CID
- 338387
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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