Molecule record

OCTADECANE

C18H38

254.50 g/mol

2D structure for OCTADECANE

Molecular properties

Formula
C18H38
Molar mass
254.50 g·mol−1
Exact mass
254.2974 Da
0
0
0
0.00 Ų
9.3 (PubChem computed XLogP3-AA descriptor)
CAS
593-45-3
PubChem CID
11635

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

No functional-group assignment has been curated yet.

Physical properties

PropertyValueConditionsSource
Logp9.3PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 1-(4-Chlorophenyl)-1,3-dihydro-2H-indol-2-one
  • 128271-18-1
  • 209-790-3
  • 593-45-3
  • C18H38
  • CCRIS 681
  • CHEBI:32926
  • DTXCID7027172
Show all 22 synonyms
  • DTXSID9047172
  • MFCD00009007
  • N102P6HAIU
  • NSC-4201
  • Octadecan
  • Octadecane, 99%
  • Octadecane, analytical standard
  • Octadecane, n-
  • Oktadekan
  • RefChem:6081
  • TS Paraffin TS 8
  • UNII-N102P6HAIU
  • n-Octadecane
  • octadecane, 14C-labeled cpd

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCCC
Isomeric SMILES
CCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C18H38/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h3-18H2,1-2H3
InChIKey
RZJRJXONCZWCBN-UHFFFAOYSA-N
PubChem CID
11635

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 OCTADECANE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for OCTADECANE; not experimental data.

Sources

Molecule identity

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

Open source record
OCTADECANE - Formula, Structure, Properties | ChemArche