Basic information
- CAS
3664-70-8- Standard SMILES
CC(=O)[C@@H]1CCC[C@H]1C- InChIKey
SIXBTZFYFSHXJI-HTRCEHHLSA-N- Molecular formula
- C8H14O
- Average molar mass
- 126.2 g/mol
- Monoisotopic mass
- 126.10446507
Names & identifiers
- Preferred name
- Ethanone, 1-(2-methylcyclopentyl)-, trans-
- IUPAC
- 1-[(1R,2R)-2-methylcyclopentyl]ethanone
Names & synonyms
NSC-23236Ethanone, 1-(2-methylcyclopentyl)-, trans-Ethanone, trans-NSC23236QFM3A7RFM3SCHEMBL13201796DTXSID509578981-Acetyl-2-methylcyclopentane, trans-403641-43-0DB-287159Ketone, methyl 2-methylcyclopentyl, trans-1-[(1R,2R)-2-Methylcyclopentyl]ethan-1-one
Show more names
Ethanone, 1-[(1R,2R)-2-methylcyclopentyl]-
Database identifiers
- CAS
3664-70-8- PubChem CID
- 229504
- DTXSID
DTXSID50957898- UNII
- QFM3A7RFM3
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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