Molecule record

octadecylbenzene

C24H42

330.60 g/mol

Loading structure

Molecular properties

Formula
C24H42
Molar mass
330.60 g·mol−1
Exact mass
330.3286 Da
4
PubChem CID
78187

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-Phenyloctadecane
  • 2-Phenyloctadecane
  • 224-684-7
  • 2PUR93PL86
  • 4445-07-2
  • Benzene, octadecyl-
  • C24H42
  • EC 224-684-7
Show all 24 synonyms
  • EINECS 224-684-7
  • MFCD00048500
  • NSC 41235
  • NSC41235
  • Octadecane, 1-phenyl-
  • Octadecane, 1-phenyl-(8CI)
  • RefChem:562761
  • SCHEMBL143654
  • SCHEMBL1553239
  • SCHEMBL225807
  • SCHEMBL258262
  • SCHEMBL282235
  • SCHEMBL304189
  • Stearylbenzene
  • UNII-2PUR93PL86
  • n-Octadecylbenzene

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCCCc1ccccc1
Isomeric SMILES
CCCCCCCCCCCCCCCCCCC1=CC=CC=C1
InChI
InChI=1S/C24H42/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-24-22-19-17-20-23-24/h17,19-20,22-23H,2-16,18,21H2,1H3
InChIKey
WSVDSBZMYJJMSB-UHFFFAOYSA-N
PubChem CID
78187

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 octadecylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for octadecylbenzene; 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
octadecylbenzene - Formula, Structure | ChemArche