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Molecule record

3-propoxyaniline

C9H13NO

151.21 g/mol

Loading structure

Molecular properties

Formula
C9H13NO
Molar mass
151.21 g·mol−1
Exact mass
151.0997 Da
4
PubChem CID
427432

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ether
Primary amine

Physical properties

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

Common names and synonyms

  • 3-Propoxy-phenylamine
  • 3-propoxyphenylamine
  • 4469-79-8
  • 806-256-7
  • AKOS000100803
  • CS-0117188
  • DA-05772
  • DTXCID60281277
Show all 24 synonyms
  • DTXSID50330182
  • EAA46979
  • EN300-36809
  • HMS1704A02
  • MFCD06801225
  • NS-01164
  • RefChem:505047
  • SB76437
  • SBB080014
  • SCHEMBL1804202
  • SCHEMBL2229298
  • SCHEMBL3210284
  • SCHEMBL993788
  • ST50401471
  • VPAHCDXFLUSULH-UHFFFAOYSA-N
  • m-n-propoxy-aniline

Structure identifiers

Canonical SMILES
CCCOc1cccc(N)c1
Isomeric SMILES
CCCOC1=CC=CC(=C1)N
InChI
InChI=1S/C9H13NO/c1-2-6-11-9-5-3-4-8(10)7-9/h3-5,7H,2,6,10H2,1H3
InChIKey
VPAHCDXFLUSULH-UHFFFAOYSA-N
PubChem CID
427432

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-propoxyaniline; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-propoxyaniline; 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