7-Methyl-4-oxatricyclo[4.3.0.03,7]nonan-5-one
Basic information
- CAS
24321-82-2- Standard SMILES
CC12CCC3CC1OC(=O)C32- InChIKey
SMZYRDVBNULFDS-UHFFFAOYSA-N- Molecular formula
- C9H12O2
- Average molar mass
- 152.19 g/mol
- Monoisotopic mass
- 152.08372962
Names & identifiers
- Preferred name
- 7-Methyl-4-oxatricyclo[4.3.0.03,7]nonan-5-one
- IUPAC
- 7-methyl-4-oxatricyclo[4.3.0.03,7]nonan-5-one
Names & synonyms
NSC16751624321-82-2DTXSID00304833NSC-1675166a-Methylhexahydro-3H-1,4-methanocyclopenta[c]furan-3-one
Database identifiers
- CAS
24321-82-2- PubChem CID
- 296944
- DTXSID
DTXSID00304833
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 236
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Compound notes
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