Cyclopent[e]-1,3-oxazin-4(5H)-one, 2-(4-chlorophenoxy)-6,7-dihydro-
Basic information
- CAS
61387-22-2- Standard SMILES
O=c1nc(Oc2ccc(Cl)cc2)oc2c1CCC2- InChIKey
ONCXAHZPAVMQSE-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO3
- Average molar mass
- 263.67 g/mol
- Monoisotopic mass
- 263.0349209
Names & identifiers
- Preferred name
- Cyclopent[e]-1,3-oxazin-4(5H)-one, 2-(4-chlorophenoxy)-6,7-dihydro-
- IUPAC
- 2-(4-chlorophenoxy)-6,7-dihydro-5H-cyclopenta[e][1,3]oxazin-4-one
Names & synonyms
61387-22-2Cyclopent[e]-1,3-oxazin-4(5H)-one, 2-(4-chlorophenoxy)-6,7-dihydro-DTXSID904865562-(4-chlorophenoxy)-6,7-dihydrocyclopenta[e][1,3]oxazin-4(5H)-one
Database identifiers
- CAS
61387-22-2- PubChem CID
- 12301547
- DTXSID
DTXSID90486556
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 422
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Compound notes
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