Molecular properties
- Formula
- C4H9Cl
- Molar mass
- 92.57 g·mol−1
- Exact mass
- 92.0393 Da
- 0
- 0
- 0
- 0.00 Ų
- 2.3 (PubChem computed XLogP3-AA descriptor)
- CAS
- 78-86-4
- PubChem CID
- 6563
Molecule record
2-CHLOROBUTANE
C4H9Cl
92.57 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 | 2.3 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- (+/-)-2-Chlorobutane
- 1-Methylpropyl chloride
- 1-chloro-1-methylpropane
- 2-Chloro-butane
- 2-Chlorobutane, >=99%
- 201-151-7
- 78-86-4
- AV999R2773
Show all 22 synonyms
- BRN 1718770
- Butane, 2-chloro-
- CCRIS 9391
- CHEBI:166855
- DTXCID303966
- DTXSID9023966
- EC 201-151-7
- EINECS 201-151-7
- MFCD00000871
- RefChem:86464
- Sec-C4H9Cl
- UNII-AV999R2773
- sec-Butyl chloride
- sec.-butyl chloride
Structure identifiers
- Canonical SMILES
- CCC(C)Cl
- Isomeric SMILES
- CCC(C)Cl
- InChI
- InChI=1S/C4H9Cl/c1-3-4(2)5/h4H,3H2,1-2H3
- InChIKey
- BSPCSKHALVHRSR-UHFFFAOYSA-N
- PubChem CID
- 6563
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-CHLOROBUTANE; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-CHLOROBUTANE; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.