Molecular properties
- Formula
- C12H26
- Molar mass
- 170.33 g·mol−1
- Exact mass
- 170.2035 Da
- 0
- 0
- 0
- 0.00 Ų
- 6.1 (PubChem computed XLogP3-AA descriptor)
- CAS
- 112-40-3
- PubChem CID
- 8182
Molecule record
DODECANE
C12H26
170.33 g/mol
Interactions
- Polarity
- Often weakly polar or nonpolar unless other structural features dominate.
- 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
No functional-group assignment has been curated yet.
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 6.1 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 112-40-3
- 11A386X1QH
- 203-967-9
- 93685-81-5
- Adakane 12
- Ba 51-090453
- Bihexyl
- CHEBI:28817
Show all 22 synonyms
- DTXCID906913
- DTXSID0026913
- Dihexyl
- Duodecane
- Hydrocarbons, C4,1,3-butadiene-free, polymd., triisobutylene fraction, hydrogenated
- MFCD00008969
- N-Dodecan
- NSC 8714
- NSC-8714
- RefChem:5775
- Undecane, methyl-
- dodecan
- n-Dodecan [German]
- n-Dodecane
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCCC
- Isomeric SMILES
- CCCCCCCCCCCC
- InChI
- InChI=1S/C12H26/c1-3-5-7-9-11-12-10-8-6-4-2/h3-12H2,1-2H3
- InChIKey
- SNRUBQQJIBEYMU-UHFFFAOYSA-N
- PubChem CID
- 8182
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for DODECANE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for DODECANE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.