1,2-Dihydrochrysene-1,2,3-triol
Basic information
- CAS
84498-35-1- Standard SMILES
OC1=Cc2c(ccc3c2ccc2ccccc23)C(O)C1O- InChIKey
RLSOUBJJKOWGAT-UHFFFAOYSA-N- Molecular formula
- C18H14O3
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.0942943
Names & identifiers
- Preferred name
- 1,2-Dihydrochrysene-1,2,3-triol
- IUPAC
- 1,2-dihydrochrysene-1,2,3-triol
Names & synonyms
84498-35-11,2-dihydrochrysene-1,2,3-triol1,2,3-Chrysenetriol, 1,2-dihydro-DTXSID0010047661,2,3-trihydroxy-1,2-dihydrochrysene
Database identifiers
- CAS
84498-35-1- PubChem CID
- 186306
- DTXSID
DTXSID001004766
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 432
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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