Molecule record

1-Hexadecanol

C16H34O

242.44 g/mol

2D structure for 1-Hexadecanol

Molecular properties

Formula
C16H34O
Molar mass
242.44 g·mol−1
Exact mass
242.2610 Da
0
1
1
20.20 Ų
7.3 (PubChem computed XLogP3-AA descriptor)
CAS
36653-82-4
PubChem CID
2682

Interactions

Polarity
Often polar; exact polarity depends on size, substitution, and ionization state.
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

Alcohol

Physical properties

PropertyValueConditionsSource
Logp7.3PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 36653-82-4
  • Atalco C
  • Cetaffine
  • Cetal
  • Cetalol CA
  • Cetanol
  • Cetylic alcohol
  • Cetylol
Show all 22 synonyms
  • Crodacol C
  • Crodacol-CAS
  • Crodacol-CAT
  • Ethal
  • Ethol
  • Hexadecan-1-ol
  • Hexadecyl alcohol
  • Loxanol K
  • N-Hexadecanol
  • Palmityl alcohol
  • cetyl alcohol
  • n-1-Hexadecanol
  • n-Cetyl alcohol
  • n-Hexadecyl alcohol

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCO
Isomeric SMILES
CCCCCCCCCCCCCCCCO
InChI
InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
InChIKey
BXWNKGSJHAJOGX-UHFFFAOYSA-N
PubChem CID
2682

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

3350 cm−1broad O-H (simulated)
2960 cm−1sp3 C-H (simulated)

Simulated NMR

On-demand educational prediction for 1-Hexadecanol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-Hexadecanol; 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