Molecule record

3-fluorooctane

C8H17F

132.22 g/mol

Loading structure

Molecular properties

Formula
C8H17F
Molar mass
132.22 g·mol−1
Exact mass
132.1314 Da
0
PubChem CID
23234174

Functional groups

Alkane / alkyl carbon
Alkyl halide

Physical properties

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

Common names and synonyms

  • 3-fluoro-octane
  • SCHEMBL2534608
  • SCHEMBL27902989
  • SCHEMBL5175306
  • SCHEMBL5985987

Structure identifiers

Canonical SMILES
CCCCCC(F)CC
Isomeric SMILES
CCCCCC(CC)F
InChI
InChI=1S/C8H17F/c1-3-5-6-7-8(9)4-2/h8H,3-7H2,1-2H3
InChIKey
CEFNSYYVHLDONX-UHFFFAOYSA-N
PubChem CID
23234174

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 3-fluorooctane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-fluorooctane; 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