Molecular properties
- Formula
- C8H17Br
- Molar mass
- 193.12 g·mol−1
- Exact mass
- 192.0514 Da
- 0
- 0
- 0
- 0.00 Ų
- 4.3 (PubChem computed XLogP3-AA descriptor)
- CAS
- 557-35-7
- PubChem CID
- 79046
Molecule record
2-Bromooctane
C8H17Br
193.12 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 | 4.3 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- (+-)-2-BROMOOCTANE
- 1-Methylheptyl bromide
- 1-bromoethylhexane
- 2-Bromoooctane
- 2-Octyl bromide
- 2-bromo-octane
- 209-171-8
- 557-35-7
Show all 22 synonyms
- DTXCID10214196
- DTXSID90880631
- EINECS 209-171-8
- K51199TJ7S
- MFCD00040823
- NSC 8060
- NSC-8060
- Octane, 2-bromo-
- RefChem:884777
- SEC-OCTYL BROMIDE [MI]
- Sec-octyl bromide, (+-)-
- UNII-K51199TJ7S
- sec-Octyl bromide
- sec-Octyl bromide (VAN)
Structure identifiers
- Canonical SMILES
- CCCCCCC(C)Br
- Isomeric SMILES
- CCCCCCC(C)Br
- InChI
- InChI=1S/C8H17Br/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3
- InChIKey
- FTJHYGJLHCGQHQ-UHFFFAOYSA-N
- PubChem CID
- 79046
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-Bromooctane; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-Bromooctane; not experimental data.
Sources
Molecule identity
Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.