Molecular properties
- Formula
- C12H18O
- Molar mass
- 178.28 g·mol−1
- Exact mass
- 178.1358 Da
- 4
- PubChem CID
- 18594
Molecule record
2-hexylphenol
C12H18O
178.28 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Phenol
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2-n-Hexylphenol
- 3226-32-2
- 4-06-00-03414 (Beilstein Handbook Reference)
- ABMULKFGWTYIIK-UHFFFAOYSA-N
- BRN 1943750
- DTXCID10108501
- DTXSID00186010
- PHENOL, o-HEXYL-
Show all 20 synonyms
- Phenol, 2-hexyl-
- RefChem:87316
- SCHEMBL184662
- SCHEMBL3026008
- SCHEMBL3235877
- SCHEMBL395989
- SCHEMBL5216934
- SCHEMBL5271863
- SCHEMBL743669
- SCHEMBL743670
- hexylphenol
- o-Hexylphenol
Structure identifiers
- Canonical SMILES
- CCCCCCc1ccccc1O
- Isomeric SMILES
- CCCCCCC1=CC=CC=C1O
- InChI
- InChI=1S/C12H18O/c1-2-3-4-5-8-11-9-6-7-10-12(11)13/h6-7,9-10,13H,2-5,8H2,1H3
- InChIKey
- ABMULKFGWTYIIK-UHFFFAOYSA-N
- PubChem CID
- 18594
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 2-hexylphenol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-hexylphenol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.