Molecule record

2-pentylphenol

C11H16O

164.25 g/mol

Loading structure

Molecular properties

Formula
C11H16O
Molar mass
164.25 g·mol−1
Exact mass
164.1201 Da
4
PubChem CID
61084

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

  • 1322-06-1
  • 136-81-2
  • 205-261-6
  • 3176RB3Z0L
  • 4-06-00-03368 (Beilstein Handbook Reference)
  • AI3-00455
  • AMYL PHENOL, O-
  • BRN 2437418
Show all 24 synonyms
  • DTXCID5034351
  • DTXSID0059665
  • EINECS 205-261-6
  • NSC 309965
  • PHENOL, 2-PENTYL-
  • Pentylphenol
  • Phenol, o-pentyl-
  • Phenol, pentyl-
  • RefChem:855305
  • SCHEMBL2524167
  • SCHEMBL30969
  • SCHEMBL376413
  • UNII-3176RB3Z0L
  • o-Amylphenol
  • o-Pentylphenol
  • orb1695802

Structure identifiers

Canonical SMILES
CCCCCc1ccccc1O
Isomeric SMILES
CCCCCC1=CC=CC=C1O
InChI
InChI=1S/C11H16O/c1-2-3-4-7-10-8-5-6-9-11(10)12/h5-6,8-9,12H,2-4,7H2,1H3
InChIKey
MEEKGULDSDXFCN-UHFFFAOYSA-N
PubChem CID
61084

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 2-pentylphenol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-pentylphenol; 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
2-pentylphenol - Formula, Structure | ChemArche