Basic information
- CAS
67237-38-1- Standard SMILES
c1cc2ccc3cc4c(cc3c2c2c1CC2)CC4- InChIKey
JURYTAHXWYUYDV-UHFFFAOYSA-N- Molecular formula
- C18H14
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.10955045
Names & identifiers
- Preferred name
- Dicyclobuta(b,g)phenanthrene, 1,2,8,9-tetrahydro-
- IUPAC
- pentacyclo[10.6.0.02,9.03,6.014,17]octadeca-1(18),2(9),3(6),7,10,12,14(17)-heptaene
Names & synonyms
Dicyclobuta(b,g)phenanthrene, 1,2,8,9-tetrahydro-67237-38-1SCHEMBL10379487DTXSID302175631,2,8,9-Tetrahydrodicyclobuta[b,g]phenanthrene
Database identifiers
- CAS
67237-38-1- PubChem CID
- 149407
- DTXSID
DTXSID30217563
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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