Basic information
- CAS
56922-88-4- Standard SMILES
CC(C)C(=O)C1=CCCCC1- InChIKey
CZUHTUVRLZFIGP-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Overview
See also: 1-Propanone, 1-(1-cyclohexen-1-yl)-2-methyl- (annotation moved to).
Names & identifiers
- Preferred name
- 1-(1-Cyclohexenyl)-2-methylpropan-1-one
- IUPAC
- 1-(cyclohexen-1-yl)-2-methylpropan-1-one
- English name
- 1-(1-cyclohexenyl)-2-methylpropan-1-one
- Molecular formula
- C10H16O
- Molecular weight
- 152.23
Names & synonyms
56922-88-41-(1-Cyclohexenyl)-2-methylpropan-1-one1-(cyclohex-1-en-1-yl)-2-methylpropan-1-oneEINECS 260-445-3SCHEMBL4212578DTXSID60205473CZUHTUVRLZFIGP-UHFFFAOYSA-NAKOS011356747DB-310802NS000336051-Cyclohex-1-enyl-2-methyl-propan-1-one1-(1-Cyclohexen-1-yl)-2-methyl-1-propanone
Show more names
1-Propanone, 1-(1-cyclohexen-1-yl)-2-methyl-
Database identifiers
- CAS
56922-88-4- PubChem CID
- 92574
- DTXSID
DTXSID60205473- EC Number
- 260-445-3
- Nikkaji
- J267.139E
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Melting point
- 0.25 °C · 0.25 °C
- Boiling point
- 96 °C · 96 °C(Press: 9 Torr)
- Density
- 0.955 g/cm3 · 0.955 g/cm3(Temp: 17 °C)
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
PRINCETON[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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