Molecular properties
- Formula
- C5H11I
- Molar mass
- 198.05 g·mol−1
- Exact mass
- 197.9906 Da
- 0
- 0
- 0
- 0.00 Ų
- 3.4 (PubChem computed XLogP3-AA descriptor)
- CAS
- 637-97-8
- PubChem CID
- 12513
Molecule record
2-IODOPENTANE
C5H11I
198.05 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 | 3.4 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 2-Jodpentan
- 211-311-8
- 637-97-8
- AAA63797
- DTXCID50818435
- DTXSID00870740
- EINECS 211-311-8
- JUPBFIYJUCWJCT-UHFFFAOYSA-N
Show all 22 synonyms
- NSC 7902
- NSC-7902
- NSC7902
- Pentane, 2-iodo-
- Pentane, 2-iodo-, (.+/-.)-
- RefChem:87693
- SCHEMBL1040900
- SCHEMBL1567407
- SCHEMBL2800419
- SCHEMBL2802830
- SCHEMBL7869325
- SCHEMBL7869366
- s-Amyliodide
- sec-Amyl iodide
Structure identifiers
- Canonical SMILES
- CCCC(C)I
- Isomeric SMILES
- CCCC(C)I
- InChI
- InChI=1S/C5H11I/c1-3-4-5(2)6/h5H,3-4H2,1-2H3
- InChIKey
- JUPBFIYJUCWJCT-UHFFFAOYSA-N
- PubChem CID
- 12513
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 2-IODOPENTANE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-IODOPENTANE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.