Molecular properties
- Formula
- C13H27I
- Molar mass
- 310.26 g·mol−1
- Exact mass
- 310.1157 Da
- 0
- 0
- 0
- 0.00 Ų
- 7.9 (PubChem computed XLogP3-AA descriptor)
- CAS
- 35599-77-0
- PubChem CID
- 545617
Molecule record
1-Iodotridecane
C13H27I
310.26 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
Alkyl halide
Physical properties
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 7.9 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1-IODO TRIDECANE
- 1-Iodotridecane #
- 1-Iodotridecane;Tridecyl iodide
- 35599-77-0
- DTXSID60337940
- E72422
- MFCD31802033
- RefChem:1055656
Show all 12 synonyms
- SCHEMBL1373809
- Tridecane, 1-iodo-
- Tridecyl iodide
- iodotridecane
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCCCCI
- Isomeric SMILES
- CCCCCCCCCCCCCI
- InChI
- InChI=1S/C13H27I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-13H2,1H3
- InChIKey
- XGAMQNYEIPCUIZ-UHFFFAOYSA-N
- PubChem CID
- 545617
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 1-Iodotridecane; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-Iodotridecane; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.