7-Chloro-2-phenyl-4h-3,1-benzoxazin-4-one
Basic information
- CAS
7033-52-5- Standard SMILES
O=c1oc(-c2ccccc2)nc2cc(Cl)ccc12- InChIKey
PXIUCZXQBGRZNO-UHFFFAOYSA-N- Molecular formula
- C14H8ClNO2
- Average molar mass
- 257.67 g/mol
- Monoisotopic mass
- 257.0243562
Names & identifiers
- Preferred name
- 7-Chloro-2-phenyl-4h-3,1-benzoxazin-4-one
- IUPAC
- 7-chloro-2-phenyl-3,1-benzoxazin-4-one
Names & synonyms
7-chloro-2-phenyl-4h-3,1-benzoxazin-4-one7033-52-57-chloro-2-phenyl-3,1-benzoxazin-4-one7-chloro-2-phenyl-4h-benzo[d][1,3]oxazin-4-oneNSC159069DTXSID60303564BDBM222136NSC-1590697-Chloro-2-phenyl-4H-3,1-benzoxazin-4-one (26)
Database identifiers
- CAS
7033-52-5- PubChem CID
- 292879
- DTXSID
DTXSID60303564- Nikkaji
- J1.272.978B
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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