Molecule record

icosylbenzene

C26H46

358.65 g/mol

Loading structure

Molecular properties

Formula
C26H46
Molar mass
358.65 g·mol−1
Exact mass
358.3600 Da
4
PubChem CID
16975

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-PHENYLEICOSANE
  • 1-phenyl-eicosane
  • 2398-68-7
  • 634-990-6
  • Benzene, eicosyl-
  • DTXSID50178703
  • Eicosane, 1-phenyl-
  • Icosylbenzene #
Show all 18 synonyms
  • NSC 123363
  • NSC123363
  • RefChem:562678
  • SCHEMBL143463
  • SCHEMBL1611454
  • SCHEMBL2963936
  • SCHEMBL302781
  • SCHEMBL3668533
  • SCHEMBL5207581
  • n-Eicosylbenzene

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCCCCCc1ccccc1
Isomeric SMILES
CCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1
InChI
InChI=1S/C26H46/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23-26-24-21-19-22-25-26/h19,21-22,24-25H,2-18,20,23H2,1H3
InChIKey
HPPLZROUJULWGU-UHFFFAOYSA-N
PubChem CID
16975

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 icosylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for icosylbenzene; 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