Molecule record

1-EICOSENE

C20H40

280.50 g/mol

2D structure for 1-EICOSENE

Molecular properties

Formula
C20H40
Molar mass
280.50 g·mol−1
Exact mass
280.3130 Da
1
0
0
0.00 Ų
11.1 (PubChem computed XLogP3-AA descriptor)
CAS
3452-07-1
PubChem CID
18936

Interactions

Polarity
Often weakly polar or nonpolar unless other structural features dominate.
Acid-base behavior
Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
Intermolecular forces
Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.

Functional groups

Alkene

Physical properties

PropertyValueConditionsSource
Logp11.1PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • .alpha.-Eicosene
  • 1-Icosene
  • 222-374-6
  • 27323-11-1
  • 27400-78-8
  • 3452-07-1
  • 6BHH7ZD637
  • Arachidene
Show all 22 synonyms
  • Arachydene
  • Cetyl ethylene
  • DTXCID609257
  • DTXSID1029257
  • Eicosene
  • Icos-1-ene
  • MFCD00009013
  • Methylene nonadecane
  • NSC 77138
  • NSC-77138
  • Neodene 20
  • RefChem:6718
  • alpha-Eicosene
  • cosen

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCCCC=C
Isomeric SMILES
CCCCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3H,1,4-20H2,2H3
InChIKey
VAMFXQBUQXONLZ-UHFFFAOYSA-N
PubChem CID
18936

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

Simulated FTIR trace

Predicted FTIR / %T

4 cm-1 resolution / deterministic instrument profile

Hover for cursor
4000350030002500200015001000500100500wavenumber (cm−1)transmittance (%)

Peak assignments

1645 cm−1C=C alkene (simulated)
2960 cm−1sp3 C-H (simulated)

Simulated NMR

On-demand educational prediction for 1-EICOSENE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-EICOSENE; not experimental data.

Sources

Molecule identity

Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.

simulated IR

ChemForge original educational simulation.

Open source record