Basic information
- Standard SMILES
Oc1ccc2c(c1)C(O)CC(c1cccc(Cl)c1)O2- InChIKey
VIGXNADVCFHPTH-UHFFFAOYSA-N- Molecular formula
- C15H13ClO3
- Average molar mass
- 276.71 g/mol
Names & identifiers
- Preferred name
- 2-(3-Chlorophenyl)chroman-4,6-diol
- IUPAC
- 2-(3-chlorophenyl)-3,4-dihydro-2H-chromene-4,6-diol
Names & synonyms
SCHEMBL4362107VIGXNADVCFHPTH-UHFFFAOYSA-N2-(3-Chlorophenyl)chroman-4,6-diol2-(3-chloro-phenyl)chroman-4,6-diol
Database identifiers
- PubChem CID
- 17978490
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 312
Related reactions
4 records
Compound notes
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