Molecule record

1-BROMODECANE

C10H21Br

221.18 g/mol

2D structure for 1-BROMODECANE

Molecular properties

Formula
C10H21Br
Molar mass
221.18 g·mol−1
Exact mass
220.0827 Da
0
0
0
0.00 Ų
6 (PubChem computed XLogP3-AA descriptor)
CAS
112-29-8
PubChem CID
8173

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

PropertyValueConditionsSource
Logp6PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 1-Decyl bromide
  • 1-bromo-decane
  • 112-29-8
  • 203-955-3
  • AI3-28586
  • DTXCID3030133
  • DTXSID9051581
  • Decane, 1-bromo-
Show all 22 synonyms
  • Decane, bromo-
  • Decyl bromide
  • Decyl monobromide
  • Decylbromide
  • EINECS 203-955-3
  • MFCD00000221
  • NSC 8780
  • NSC-8780
  • RefChem:75157
  • Y2JDF9ZCB6
  • bromodecane
  • decylmonobromide
  • n-Decyl bromide
  • n-decylbromide

Structure identifiers

Canonical SMILES
CCCCCCCCCCBr
Isomeric SMILES
CCCCCCCCCCBr
InChI
InChI=1S/C10H21Br/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
MYMSJFSOOQERIO-UHFFFAOYSA-N
PubChem CID
8173

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-BROMODECANE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-BROMODECANE; not experimental data.

Sources

Molecule identity

Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record