Molecular properties
- Formula
- C14H28O
- Molar mass
- 212.37 g·mol−1
- Exact mass
- 212.2140 Da
- 1
- 0
- 1
- 17.10 Ų
- 5.5 (PubChem computed XLogP3-AA descriptor)
- CAS
- 26496-20-8
- PubChem CID
- 98674
Molecule record
4-Tetradecanone
C14H28O
212.37 g/mol
Interactions
- 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.
Functional groups
Ketone
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 5.5 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 26496-20-8
- 4-Tetradekanon
- DTXSID00867630
- EINECS 247-747-0
- NS00012780
- NSC 158501
- NSC-158501
- NSC158501
Show all 11 synonyms
- SCHEMBL1412994
- SCHEMBL7621914
- Tetradecan-4-one
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCC(=O)CCC
- Isomeric SMILES
- CCCCCCCCCCC(=O)CCC
- InChI
- InChI=1S/C14H28O/c1-3-5-6-7-8-9-10-11-13-14(15)12-4-2/h3-13H2,1-2H3
- InChIKey
- OWIOJZLDFONFSU-UHFFFAOYSA-N
- PubChem CID
- 98674
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
Simulated FTIR trace
Predicted FTIR / %T
4 cm-1 resolution / deterministic instrument profile
Hover for cursor
Peak assignments
1715 cm−1C=O ketone (simulated)
2960 cm−1sp3 C-H (simulated)
Simulated NMR
On-demand educational prediction for 4-Tetradecanone; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-Tetradecanone; 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.