Molecule record

4-octylaniline

C14H23N

205.34 g/mol

Loading structure

Molecular properties

Formula
C14H23N
Molar mass
205.34 g·mol−1
Exact mass
205.1830 Da
4
PubChem CID
85346

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

  • 16245-79-7
  • 240-358-7
  • 4-(n-octyl)anilin
  • 4-Octylaniline, 99%
  • 4-Octylphenylamine
  • 4-n-Octylaniline
  • 4-octyl aniline
  • 4-octylbenzenamine
Show all 24 synonyms
  • AKOS015839936
  • ANILINE, P-OCTYL-
  • Benzenamine, 4-octyl-
  • DTXCID802266
  • DTXSID6022266
  • EINECS 240-358-7
  • F0001-0584
  • MFCD00007929
  • O9FN212WZZ
  • RefChem:526074
  • SB78179
  • SCHEMBL111952
  • SY052531
  • UNII-O9FN212WZZ
  • p-Octylaniline
  • p-n-octylaniline

Structure identifiers

Canonical SMILES
CCCCCCCCc1ccc(N)cc1
Isomeric SMILES
CCCCCCCCC1=CC=C(C=C1)N
InChI
InChI=1S/C14H23N/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-8,15H2,1H3
InChIKey
ORKQJTBYQZITLA-UHFFFAOYSA-N
PubChem CID
85346

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-octylaniline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-octylaniline; 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