Cyclopentanone, 2-(1-oxopropyl)-
Basic information
- CAS
7391-48-2- Standard SMILES
CCC(=O)C1CCCC1=O- InChIKey
LYGKNTGKONXCRZ-UHFFFAOYSA-N- Molecular formula
- C8H12O2
- Average molar mass
- 140.18 g/mol
- Monoisotopic mass
- 140.08372962
Names & identifiers
- Preferred name
- Cyclopentanone, 2-(1-oxopropyl)-
- IUPAC
- 2-propanoylcyclopentan-1-one
- English name
- 2-(1-oxopropyl)cyclopentan-1-one
- Molecular formula
- C8H12O2
- Molecular weight
- 140.18
Names & synonyms
7391-48-2Cyclopentanone, 2-(1-oxopropyl)-2-(1-Oxopropyl)cyclopentanoneEINECS 230-979-1DTXSID80884380RefChem:129873DTXCID2010238232-propanoylcyclopentan-1-one2-(1-Oxopropyl)cyclopentan-1-one2-Propionylcyclopentan-1-oneSCHEMBL535037LYGKNTGKONXCRZ-UHFFFAOYSA-N
Show more names
2-Propanoylcyclopentanone2-(1-Propionyl)cyclopentanone
AKOS011021960NS00047110EN300-1124925
Database identifiers
- CAS
7391-48-2- PubChem CID
- 110982
- DTXSID
DTXSID80884380- EC Number
- 230-979-1
- Nikkaji
- J278.805E
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Boiling point
- 90 °C · 90 °C(Press: 13 Torr)
- Density
- 1.054 · 1.054±0.06 g/cm3(Predicted)
- pka
- 10.76 · 10.76±0.20(Predicted)
- EPA Substance Registry System
- 2 · Cyclopentanone, 2-(1-oxopropyl)- (7391-48-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Cyclopentanone, 2-(1-oxopropyl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclopentanone, 2-(1-oxopropyl)-: INACTIVE
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Compound notes
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