Basic information
- CAS
30545-23-4- Standard SMILES
O=C1C2CC3C4CC5CC3C1C(C5)C4C2- InChIKey
WOLSPKYGHOUIFM-UHFFFAOYSA-N- Molecular formula
- C14H18O
- Average molar mass
- 202.29 g/mol
Names & identifiers
- Preferred name
- Diamantanone
- IUPAC
- pentacyclo[7.3.1.14,12.02,7.06,11]tetradecan-3-one
Names & synonyms
Diamantanone30545-23-43-OxodiamantaneWOLSPKYGHOUIFM-UHFFFAOYSA-NOctahydro-2,8,4,6-(epibutane[1,2,3,4]tetrayl)naphthalen-1(2H)-one
Database identifiers
- CAS
30545-23-4- PubChem CID
- 141569
- Nikkaji
- J312.865B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 336
Related reactions
1 records
Compound notes
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