Basic information
- CAS
26495-88-5- Standard SMILES
OCC1C2c3ccccc3C(c3ccccc32)C1CO- InChIKey
JRUAWKGGVJZZQC-UHFFFAOYSA-N- Molecular formula
- C18H18O2
- Average molar mass
- 266.3 g/mol
- Monoisotopic mass
- 266.13067981
Names & identifiers
- Preferred name
- trans-9,10-Dihydro-9,10-ethanoanthracene-11,12-dimethanol
- IUPAC
- [16-(hydroxymethyl)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methanol
Names & synonyms
26495-88-5[16-(hydroxymethyl)tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaen-15-yl]methanoltrans-9,10-Dihydro-9,10-ethanoanthracene-11,12-dimethanol(9,10-Dihydro-9,10-ethanoanthracene-11,12-diyl)dimethanoltetracyclo[6.6.2.0~2,7~.0~9,14~]hexadeca-2,4,6,9,11,13-hexaene-15,16-diyldimethanol5445-55-6Maybridge3_001027Oprea1_148579CBDivE_000123MLS000851196SCHEMBL561629CHEMBL1377175
Show more names
SCHEMBL26668741DTXSID20949366JRUAWKGGVJZZQC-UHFFFAOYSA-NJRUAWKGGVJZZQC-VNGAXPGBSA-NHMS1433O15HMS2807D21NSC135356CCG-242635
Database identifiers
- CAS
26495-88-5- PubChem CID
- 282176
- DTXSID
DTXSID20949366- ChEMBL
CHEMBL1377175- Nikkaji
- J1.470.014E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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