Molecule record

2-Octadecanone

C₁₈H₃₆O

268.50 g/mol

Molecular properties

Polarity: Polar functional group with nonpolar contribution from the carbon skeleton.
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.

Ketone

Property	Value	Conditions	Source
Logp	7.9	PubChem computed XLogP3-AA descriptor	PubChem(link only)

Show all 17 synonyms

Canonical SMILES: CCCCCCCCCCCCCCCCC(=O)C
Isomeric SMILES: CCCCCCCCCCCCCCCCC(=O)C
InChI: InChI=1S/C18H36O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)19/h3-17H2,1-2H3
InChIKey: PJLJQAWUAPNCJC-UHFFFAOYSA-N
PubChem CID: 81844

Tabs appear only for spectra stored with clear provenance.

Predicted FTIR / %T

4 cm^-1 resolution / deterministic instrument profile

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ResolutionNoise

1715 cm⁻¹C=O ketone (simulated)

2960 cm⁻¹sp3 C-H (simulated)

On-demand educational prediction for 2-Octadecanone; not experimental data.

On-demand educational fragmentation for 2-Octadecanone; not experimental data.

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

ChemForge original educational simulation.