Molecule record

undecylbenzene

C17H28

232.41 g/mol

Loading structure

Molecular properties

Formula
C17H28
Molar mass
232.41 g·mol−1
Exact mass
232.2191 Da
4
PubChem CID
23194

Functional groups

Alkane / alkyl carbon
Aromatic ring

Physical properties

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

Common names and synonyms

  • 1-Phenylundecane
  • 1Phenylundecane
  • 229-806-2
  • 29463-63-6
  • 8C9LPO3Q9T
  • Benzene, undecyl
  • Benzene, undecyl-
  • DTXCID109281
Show all 24 synonyms
  • DTXSID10872311
  • DTXSID3029281
  • EINECS 229-806-2
  • HSDB 5177
  • NSC 251008
  • Phenylundecane
  • RefChem:193118
  • UNDECYLBENZENE [HSDB]
  • UNII-8C9LPO3Q9T
  • Undecane, 1-phenyl-
  • Undecane, 1-phenyl-(8CI)
  • Undecane, 1phenyl
  • Undecanylbenzene
  • XBEADGFTLHRJRB-UHFFFAOYSA-N
  • n-Undecylbenzene
  • nUndecylbenzene

Structure identifiers

Canonical SMILES
CCCCCCCCCCCc1ccccc1
Isomeric SMILES
CCCCCCCCCCCC1=CC=CC=C1
InChI
InChI=1S/C17H28/c1-2-3-4-5-6-7-8-9-11-14-17-15-12-10-13-16-17/h10,12-13,15-16H,2-9,11,14H2,1H3
InChIKey
XBEADGFTLHRJRB-UHFFFAOYSA-N
PubChem CID
23194

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 undecylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for undecylbenzene; 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