Basic information
- CAS
4041-11-6- Standard SMILES
CC1=CCC(C)C1=O- InChIKey
GBTHLOLSKPVPOD-UHFFFAOYSA-N- Molecular formula
- C7H10O
- Average molar mass
- 110.15 g/mol
- Monoisotopic mass
- 110.07316494
Names & identifiers
- Preferred name
- 2,5-Dimethylcyclopent-2-en-1-one
- IUPAC
- 2,5-dimethylcyclopent-2-en-1-one
Names & synonyms
2,5-dimethylcyclopent-2-en-1-one4041-11-6DTXSID80960810RefChem:1060119DTXCID4013886532,5-Dimethyl-2-cyclopentenoneSCHEMBL97176242,4-Dimethyl-cyclopenten-3-onGBTHLOLSKPVPOD-UHFFFAOYSA-N2.5-Dimethylcyclopent-2-en-1-onAKOS0049075672-Cyclopenten-1-one, 2,5-dimethyl-
Show more names
2,5-DIMETHYL-2-CYCLOPENTEN-1-ONE
Database identifiers
- CAS
4041-11-6- PubChem CID
- 19957
- DTXSID
DTXSID80960810- Nikkaji
- J1.553.702G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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