Molecular properties
- Formula
- C11H17N
- Molar mass
- 163.26 g·mol−1
- Exact mass
- 163.1361 Da
- 4
- PubChem CID
- 19911390
Molecule record
3-pentylaniline
C11H17N
163.26 g/mol
Loading structure
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
- 57335-98-5
- A1-19844
- H29001
- OGCDCBFCCFJKTK-UHFFFAOYSA-N
- SCHEMBL28329310
- SCHEMBL292745
- SCHEMBL292942
- SCHEMBL292943
Show all 12 synonyms
- SCHEMBL29402451
- SCHEMBL5329182
- SCHEMBL5329197
- SCHEMBL6258834
Structure identifiers
- Canonical SMILES
- CCCCCc1cccc(N)c1
- Isomeric SMILES
- CCCCCC1=CC(=CC=C1)N
- InChI
- InChI=1S/C11H17N/c1-2-3-4-6-10-7-5-8-11(12)9-10/h5,7-9H,2-4,6,12H2,1H3
- InChIKey
- OGCDCBFCCFJKTK-UHFFFAOYSA-N
- PubChem CID
- 19911390
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3-pentylaniline; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-pentylaniline; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.