Basic information
- CAS
96741-20-7- Standard SMILES
Cc1cc2ccccc2c2ccc3c(c12)C=C[C@@H](O)[C@@H]3O- InChIKey
ZUQHOPBWKPIZSS-IEBWSBKVSA-N- Molecular formula
- C19H16O2
- Average molar mass
- 276.3 g/mol
- Monoisotopic mass
- 276.11502975
Names & identifiers
- Preferred name
- 1,2-CHRYSENEDIOL, 1,2-DIHYDRO-5-METHYL-, trans-(+-)-
- IUPAC
- (1R,2R)-5-methyl-1,2-dihydrochrysene-1,2-diol
Names & synonyms
1,2-CHRYSENEDIOL, 1,2-DIHYDRO-5-METHYL-, trans-(+-)-96741-20-7BRN 5568526CCRIS 6162(1R,2R)-5-methyl-1,2-dihydrochrysene-1,2-diol(+-)-trans-1,2-Dihydro-5-methyl-1,2-chrysenediol(+-)-trans-1,2-Dihydro-1,2-dihydroxy-5-methylchryseneDTXSID10242499(+/-)-TRANS-1,2-DIHYDRO-1,2-DIHYDROXY-5-METHYLCHRYSENE
Database identifiers
- CAS
96741-20-7- PubChem CID
- 57136
- DTXSID
DTXSID10242499- Nikkaji
- J425.332I
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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