Molecule record

2-propylcyclohexan-1-one

C9H16O

140.23 g/mol

Loading structure

Molecular properties

Formula
C9H16O
Molar mass
140.23 g·mol−1
Exact mass
140.1201 Da
2
PubChem CID
7199

Functional groups

Alkane / alkyl carbon
Ketone

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 2-PROPYLCYCLOHEXANONE
  • 2-propyl-cyclohexanone
  • 202-351-7
  • 94-65-5
  • AKOS009157714
  • CS-0205078
  • Cyclohexanone, 2-propyl-
  • D92072
Show all 24 synonyms
  • DB-057517
  • DTXCID10818153
  • DTXSID20870429
  • EINECS 202-351-7
  • EN300-258698
  • F8882-5405
  • MFCD00019464
  • NS00041175
  • NSC 54015
  • NSC54015
  • OCJLPZCBZSCVCO-UHFFFAOYSA-
  • P1114
  • RefChem:580730
  • SCHEMBL420230
  • SCHEMBL6590404
  • SY053656

Structure identifiers

Canonical SMILES
CCCC1CCCCC1=O
Isomeric SMILES
CCCC1CCCCC1=O
InChI
InChI=1S/C9H16O/c1-2-5-8-6-3-4-7-9(8)10/h8H,2-7H2,1H3
InChIKey
OCJLPZCBZSCVCO-UHFFFAOYSA-N
PubChem CID
7199

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 2-propylcyclohexan-1-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-propylcyclohexan-1-one; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record