3-Chloro-2-phenyl-2,3-dihydro-4h-chromen-4-one
Basic information
- CAS
70460-47-8- Standard SMILES
O=C1c2ccccc2OC(c2ccccc2)C1Cl- InChIKey
KIJYYBKDRKGLSP-UHFFFAOYSA-N- Molecular formula
- C15H11ClO2
- Average molar mass
- 258.7 g/mol
- Monoisotopic mass
- 258.0447573
Names & identifiers
- Preferred name
- 3-Chloro-2-phenyl-2,3-dihydro-4h-chromen-4-one
- IUPAC
- 3-chloro-2-phenyl-2,3-dihydrochromen-4-one
Names & synonyms
70460-47-83-chloro-2-phenyl-2,3-dihydro-4h-chromen-4-oneDTXSID20288242RefChem:278213DTXCID102393893-chloro-2-phenylchroman-4-one3-chloro-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one3-chloroflavanoneNSC54892CHEMBL4832053-Chloro-2-phenyl-chroman-4-oneNSC-54892
Show more names
DS-0141463-Chloro-2-phenyl-2,3-dihydro-4H-1-benzopyran-4-one
Database identifiers
- CAS
70460-47-8- PubChem CID
- 244231
- DTXSID
DTXSID20288242- ChEMBL
CHEMBL483205
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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