Basic information
- Standard SMILES
OCc1ccc2ccc3c4ccccc4ccc3c2c1- InChIKey
DXYRNAPJTGXDLR-UHFFFAOYSA-N- Molecular formula
- C19H14O
- Average molar mass
- 258.3 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxymethylchrysene
- IUPAC
- chrysen-3-ylmethanol
Names & synonyms
3-Chrysenemethanol3-HydroxymethylchryseneSCHEMBL10484087DXYRNAPJTGXDLR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 15599327
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 339
Related reactions
10 records
Compound notes
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