Basic information
- Standard SMILES
O=C1C2=C(CCCC2)C2CCCCC12- InChIKey
PWIYCNRRAWIGBD-UHFFFAOYSA-N- Molecular formula
- C13H18O
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.13576519
Names & identifiers
- Preferred name
- 1,2,3,4,4a,5,6,7,8,9a-Decahydrofluoren-9-one
- IUPAC
- 1,2,3,4,4a,5,6,7,8,9a-decahydrofluoren-9-one
Names & synonyms
SCHEMBL5845434PWIYCNRRAWIGBD-UHFFFAOYSA-N1,2,3,4,4a,5,6,7,8,9a-decahydrofluoren--9-one1,2,3,4,4a,5,6,7,8,9a-decahydrofluoren-9-one1,2,3,4,4a,5,6,7,8,9a-decahydro-9H-fluoren-9-one
Database identifiers
- PubChem CID
- 21981511
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 300
Related reactions
4 records
Linked notes
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