Molecule record

CYCLOBUTANE

C4H8

56.11 g/mol

2D structure for CYCLOBUTANE

Molecular properties

Formula
C4H8
Molar mass
56.11 g·mol−1
Exact mass
56.0626 Da
1
0
0
0.00 Ų
2.5 (PubChem computed XLogP3-AA descriptor)
CAS
287-23-0
PubChem CID
9250

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

Aromatic ring

Physical properties

PropertyValueConditionsSource
Logp2.5PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 206-014-5
  • 287-23-0
  • 5X619RB2CY
  • CHEBI:30377
  • CYCLOBUTANE [HSDB]
  • CYCLOBUTANE [MI]
  • Cyclobutane [UN2601] [Flammable gas]
  • DTXCID6037853
Show all 22 synonyms
  • DTXSID2059772
  • EINECS 206-014-5
  • HSDB 58
  • RefChem:5716
  • SCHEMBL102953
  • SCHEMBL102954
  • SCHEMBL1997
  • SCHEMBL2088
  • SCHEMBL4056
  • SCHEMBL893
  • Tetramethylene
  • UN2601
  • UNII-5X619RB2CY
  • cyclobutane, tetramethylene

Structure identifiers

Canonical SMILES
C1CCC1
Isomeric SMILES
C1CCC1
InChI
InChI=1S/C4H8/c1-2-4-3-1/h1-4H2
InChIKey
PMPVIKIVABFJJI-UHFFFAOYSA-N
PubChem CID
9250

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

3030 cm−1aromatic C-H (simulated)
1600 cm−1aromatic C=C (simulated)
2960 cm−1sp3 C-H (simulated)

Simulated NMR

On-demand educational prediction for CYCLOBUTANE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for CYCLOBUTANE; 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