Molecular properties
- Formula
- C4H9Br
- Molar mass
- 137.02 g·mol−1
- Exact mass
- 135.9888 Da
- 0
- 0
- 0
- 0.00 Ų
- 2.3 (PubChem computed XLogP3-AA descriptor)
- CAS
- 78-76-2
- PubChem CID
- 6554
Molecule record
2-Bromobutane
C4H9Br
137.02 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-Bromobutane
- 1-Bromo-1-methylpropane
- 2-Bromo-butane
- 2-Butyl bromide
- 201-140-7
- 78-76-2
- Butane, 2-bromo-
- CCRIS 106
Show all 22 synonyms
- DTXCID201499
- DTXSID7021499
- EINECS 201-140-7
- HSDB 2197
- MFCD00000156
- Methylethylbromomethane
- NSC 8417
- NSC-8417
- RefChem:85855
- SEC-BUTYL BROMIDE
- SSI829JO4W
- Secondary butyl bromide
- UN2339
- sec-Butylbromide
Structure identifiers
- Canonical SMILES
- CCC(C)Br
- Isomeric SMILES
- CCC(C)Br
- InChI
- InChI=1S/C4H9Br/c1-3-4(2)5/h4H,3H2,1-2H3
- InChIKey
- UPSXAPQYNGXVBF-UHFFFAOYSA-N
- PubChem CID
- 6554
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-Bromobutane; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-Bromobutane; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.