Molecular properties
- Formula
- C6H14O
- Molar mass
- 102.17 g·mol−1
- Exact mass
- 102.1045 Da
- 0
- 1
- 1
- 20.20 Ų
- 1.8 (PubChem computed XLogP3-AA descriptor)
- CAS
- 626-93-7
- PubChem CID
- 12297
Molecule record
2-HEXANOL
C6H14O
102.17 g/mol
Interactions
- Polarity
- Often polar; exact polarity depends on size, substitution, and ionization state.
- 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
Alcohol
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 1.8 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- (+-)-2-Hexanol
- 2-Hexanol, (S)-
- 2-Hexyl Alcohol
- 2-Hydroxyhexane
- 210-971-4
- 54972-97-3
- 626-93-7
- 69203-06-1
Show all 21 synonyms
- 9CDT0V6T4P
- CHEBI:88370
- DTXCID70811105
- DTXSID30893088
- Hexan-2-ol; 2-Hexanol
- MFCD00004585
- NSC-3706
- Pentanol, methyl-
- RefChem:909857
- hexan-2-ol
- n-C4H9CH(OH)CH3
- s-(+)-2-hexanol
- sec-Hexanol
Structure identifiers
- Canonical SMILES
- CCCCC(C)O
- Isomeric SMILES
- CCCCC(C)O
- InChI
- InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3
- InChIKey
- QNVRIHYSUZMSGM-UHFFFAOYSA-N
- PubChem CID
- 12297
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
Simulated FTIR trace
Predicted FTIR / %T
4 cm-1 resolution / deterministic instrument profile
Hover for cursor
Peak assignments
3350 cm−1broad O-H (simulated)
2960 cm−1sp3 C-H (simulated)
Simulated NMR
On-demand educational prediction for 2-HEXANOL; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-HEXANOL; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.
simulated IR
ChemForge original educational simulation.