Molecular properties
- Formula
- C20H40O
- Molar mass
- 296.50 g·mol−1
- Exact mass
- 296.3079 Da
- 1
- 0
- 1
- 17.10 Ų
- 9.2 (PubChem computed XLogP3-AA descriptor)
- CAS
- 2400-66-0
- PubChem CID
- 75458
Molecule record
Eicosanal
C20H40O
296.50 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
Aldehyde
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 9.2 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1-EICOSANAL
- 12001-36-4
- 219-275-5
- 2400-66-0
- AI3-24217
- ALDEHYDE C-20
- CHEBI:196292
- DTXCID60101224
Show all 22 synonyms
- DTXSID00178733
- EICOSYL ALDEHYDE
- EINECS 219-275-5
- Eicosanal-
- Icosanal
- MFCD00047661
- N-EICOSANAL
- RefChem:1084060
- SCHEMBL154927
- SCHEMBL154928
- SCHEMBL20586347
- SCHEMBL27740716
- UNII-ZNJ1NXP04J
- ZNJ1NXP04J
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCCCCCCCCCCC=O
- Isomeric SMILES
- CCCCCCCCCCCCCCCCCCCC=O
- InChI
- InChI=1S/C20H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h20H,2-19H2,1H3
- InChIKey
- FWBUWJHWAKTPHI-UHFFFAOYSA-N
- PubChem CID
- 75458
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
1725 cm−1C=O aldehyde (simulated)
2720 cm−1aldehyde C-H (simulated)
2960 cm−1sp3 C-H (simulated)
Simulated NMR
On-demand educational prediction for Eicosanal; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for Eicosanal; 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.