Molecule record

3-propan-2-ylaniline

C9H13N

135.21 g/mol

Loading structure

Molecular properties

Formula
C9H13N
Molar mass
135.21 g·mol−1
Exact mass
135.1048 Da
4
PubChem CID
458679

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

  • 3-(1-METHYLETHYL)ANILINE
  • 3-Aminocumene
  • 3-Cumidine
  • 3-Isopropylaniline
  • 3-Isopropylaniline #
  • 3-Isopropylaniline, AldrichCPR
  • 3-iso-propyl-phenyl
  • 3-isopropylbenzenamine
Show all 24 synonyms
  • 5369-16-4
  • 611-035-1
  • AKOS000121419
  • Benzenamine, 3-(1-methylethyl)-
  • DTXCID40283638
  • DTXSID50332545
  • F21289
  • I0433
  • MFCD00092918
  • RefChem:502867
  • STR09900
  • SY005822
  • m-Aminocumene
  • m-Cumidine
  • m-Isopropyl Aniline
  • m-Isopropylaniline

Structure identifiers

Canonical SMILES
CC(C)c1cccc(N)c1
Isomeric SMILES
CC(C)C1=CC(=CC=C1)N
InChI
InChI=1S/C9H13N/c1-7(2)8-4-3-5-9(10)6-8/h3-7H,10H2,1-2H3
InChIKey
XCCNRBCNYGWTQX-UHFFFAOYSA-N
PubChem CID
458679

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 3-propan-2-ylaniline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-propan-2-ylaniline; 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