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Molecule record

1-UNDECANOL

C11H24O

172.31 g/mol

2D structure for 1-UNDECANOL

Molecular properties

Formula
C11H24O
Molar mass
172.31 g·mol−1
Exact mass
172.1827 Da
0
1
1
20.20 Ų
4.6 (PubChem computed XLogP3-AA descriptor)
CAS
112-42-5
PubChem CID
8184

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
Logp4.6PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 1-Hendecanol
  • 1-Undecyl alcohol
  • AI3-00330
  • Alcohol C-11
  • Alcohol C11
  • Alcohol, undecyl
  • BRN 1698334
  • C11 alcohol
Show all 22 synonyms
  • DTXSID0026915
  • Decyl carbinol
  • EINECS 203-970-5
  • HSDB 1089
  • Hendecyl alcohol
  • NSC 403667
  • Neodol 1
  • Tip-Nip
  • UNII-06MJ0P28T3
  • Undecan-1-ol
  • Undecanol
  • Undecanol-(1)
  • Undecyl alcohol
  • n-Undecan-1-ol

Structure identifiers

Canonical SMILES
CCCCCCCCCCCO
Isomeric SMILES
CCCCCCCCCCCO
InChI
InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3
InChIKey
KJIOQYGWTQBHNH-UHFFFAOYSA-N
PubChem CID
8184

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

IR spectrum

ChemArche Original Educational Content(redistributable)

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-UNDECANOL; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-UNDECANOL; not experimental data.

Sources

Molecule identity

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

PubChem(link only)

simulated IR

ChemForge original educational simulation.

ChemArche Original Educational Content(redistributable)
Open source record