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Molecule record

4-pentylaniline

C11H17N

163.26 g/mol

Loading structure

Molecular properties

Formula
C11H17N
Molar mass
163.26 g·mol−1
Exact mass
163.1361 Da
4
PubChem CID
93162

Functional groups

Alkane / alkyl carbon
Aromatic ring
Primary amine

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 33228-44-3
  • 4-Amylaniline
  • 4-Pentylaniline, 98%
  • 4-n-pentylaniline
  • 4-pentylbenzenamine
  • 4-pentylphenylamine
  • 622-989-3
  • 8ROJ0G9HIU
Show all 24 synonyms
  • ANILINE, P-PENTYL-
  • Benzenamine, 4-pentyl-
  • DGFTWBUZRHAHTH-UHFFFAOYSA-N
  • DTXCID8020707
  • DTXSID0040707
  • InChI=1/C11H17N/c1-2-3-4-5-10-6-8-11(12)9-7-10/h6-9H,2-5,12H2,1H
  • J153.245F
  • MFCD00007926
  • NCGC00255675-01
  • RefChem:100307
  • SCHEMBL109256
  • UNII-8ROJ0G9HIU
  • p-Amylaniline
  • p-Pentylaniline
  • p-n-Amylaniline
  • p-n-Pentylaniline

Structure identifiers

Canonical SMILES
CCCCCc1ccc(N)cc1
Isomeric SMILES
CCCCCC1=CC=C(C=C1)N
InChI
InChI=1S/C11H17N/c1-2-3-4-5-10-6-8-11(12)9-7-10/h6-9H,2-5,12H2,1H3
InChIKey
DGFTWBUZRHAHTH-UHFFFAOYSA-N
PubChem CID
93162

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 4-pentylaniline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-pentylaniline; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record