Basic information
- Standard SMILES
COc1cc2c(=O)c(I)c(-c3ccccc3)oc2cc1C- InChIKey
FIENTHDVFJTJCO-UHFFFAOYSA-N- Molecular formula
- C17H13IO3
- Average molar mass
- 392.19 g/mol
- Monoisotopic mass
- 391.99094
Names & identifiers
- Preferred name
- 3-Iodo-6-methoxy-7-methyl-2-phenyl-chromen-4-one
- IUPAC
- 3-iodo-6-methoxy-7-methyl-2-phenylchromen-4-one
Names & synonyms
3-iodo-6-methoxy-7-methyl-2-phenyl-chromen-4-one1279087-60-3SCHEMBL1534593FIENTHDVFJTJCO-UHFFFAOYSA-NDB-348328
Database identifiers
- PubChem CID
- 67067786
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 439
Related reactions
2 records
Compound notes
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