4H-1-Benzopyran-4-one, 7-iodo-2-phenyl-
Basic information
- CAS
1026-11-5- Standard SMILES
O=c1cc(-c2ccccc2)oc2cc(I)ccc12- InChIKey
ZGISPANOERIBTR-UHFFFAOYSA-N- Molecular formula
- C15H9IO2
- Average molar mass
- 348.13 g/mol
- Monoisotopic mass
- 347.96473
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 7-iodo-2-phenyl-
- IUPAC
- 7-iodo-2-phenylchromen-4-one
Names & synonyms
1026-11-54H-1-Benzopyran-4-one, 7-iodo-2-phenyl-7-Iodo-2-phenyl-4H-chromen-4-one4h-1-benzopyran-4-one,7-iodo-2-phenyl-7-iodo-2-phenyl-chromen-4-oneDTXSID203327947-Iodo-2-phenyl-4H-1-benzopyran-4-one
Database identifiers
- CAS
1026-11-5- PubChem CID
- 466281
- DTXSID
DTXSID20332794
Properties
Computed structural properties
- XLogP
- 4.2
- 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
- 358
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Compound notes
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