Molecular properties
- Formula
- C6H13F
- Molar mass
- 104.17 g·mol−1
- Exact mass
- 104.1001 Da
- 0
- 0
- 1
- 0.00 Ų
- 3.4 (PubChem computed XLogP3-AA descriptor)
- CAS
- 373-14-8
- PubChem CID
- 9760
Molecule record
1-FLUOROHEXANE
C6H13F
104.17 g/mol
Interactions
- Polarity
- Often weakly polar or nonpolar unless other structural features dominate.
- Acid-base behavior
- Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
- Intermolecular forces
- Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.
Functional groups
Alkyl halide
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 3.4 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1-fluoro-hexane
- 206-763-8
- 373-14-8
- 4-01-00-00348 (Beilstein Handbook Reference)
- BRN 1697058
- C6H13F
- DTXCID0039308
- DTXSID4059910
Show all 22 synonyms
- EINECS 206-763-8
- Fluorohexane
- Hexane, 1-fluoro-
- Hexyl fluoride
- MFCD00000454
- RefChem:75823
- SCHEMBL131603
- SCHEMBL2516132
- SCHEMBL277939
- SCHEMBL42871
- SCHEMBL481198
- SCHEMBL5186095
- SCHEMBL7909322
- n-Hexyl fluoride
Structure identifiers
- Canonical SMILES
- CCCCCCF
- Isomeric SMILES
- CCCCCCF
- InChI
- InChI=1S/C6H13F/c1-2-3-4-5-6-7/h2-6H2,1H3
- InChIKey
- OFERIJCSHDJMSA-UHFFFAOYSA-N
- PubChem CID
- 9760
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1-FLUOROHEXANE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-FLUOROHEXANE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.