Molecular properties
- Formula
- C12H18O
- Molar mass
- 178.28 g·mol−1
- Exact mass
- 178.1358 Da
- 4
- PubChem CID
- 17132
Molecule record
4-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
- 2446-69-7
- 3V1KE0N8D5
- 4-HEXYLBENZOLOL
- 4-Hexylphenol, AldrichCPR
- 4-n-Hexylphenol
- BIDD:ER0077
- CHEBI:34439
- DTXCID4037085
Show all 24 synonyms
- DTXSID5062425
- EINECS 219-501-2
- MFCD00051313
- MSK161794
- Phenol, 4-hexyl-
- Phenol, p-hexyl-
- RefChem:99108
- SCHEMBL10921385
- SCHEMBL152397
- SCHEMBL348087
- SCHEMBL504392
- SCHEMBL9152312
- SZWBRVPZWJYIHI-UHFFFAOYSA-N
- UNII-3V1KE0N8D5
- p-Hexylphenol
- p-n-Hexylphenol
Structure identifiers
- Canonical SMILES
- CCCCCCc1ccc(O)cc1
- Isomeric SMILES
- CCCCCCC1=CC=C(C=C1)O
- InChI
- InChI=1S/C12H18O/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10,13H,2-6H2,1H3
- InChIKey
- SZWBRVPZWJYIHI-UHFFFAOYSA-N
- PubChem CID
- 17132
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 4-hexylphenol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-hexylphenol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.