Basic information
- CAS
16508-51-3- Standard SMILES
CC12CCCCC1=CC(=O)C2- InChIKey
HJDKCIOQDUHLEF-UHFFFAOYSA-N- Molecular formula
- C10H14O
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.10446507
Names & identifiers
- Preferred name
- 7a-Methyl-1,4,5,6,7,7a-hexahydro-2H-inden-2-one
- IUPAC
- 7a-methyl-4,5,6,7-tetrahydro-1H-inden-2-one
Names & synonyms
7a-Methyl-1,4,5,6,7,7a-hexahydro-2H-inden-2-one16508-51-3DTXSID10342867RefChem:1074554DTXCID702939477a-methyl-4,5,6,7-tetrahydro-1H-inden-2-oneY-METHYLBICYCLO(4.3.0)NON-6-EN-8-ONE
Database identifiers
- CAS
16508-51-3- PubChem CID
- 585263
- DTXSID
DTXSID10342867- Nikkaji
- J47.930F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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