Molecule record

bromocycloheptane

C7H13Br

177.08 g/mol

Loading structure

Molecular properties

Formula
C7H13Br
Molar mass
177.08 g·mol−1
Exact mass
176.0201 Da
1
PubChem CID
16992

Functional groups

Alkane / alkyl carbon
Alkyl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-bromocycloheptane
  • 2-bromocycloheptane
  • 219-294-9
  • 2404-35-5
  • Bromocycloheptane, 97%
  • Bromocycloheptane,97%
  • Cycloheptane, bromo-
  • Cycloheptyl bromide
Show all 24 synonyms
  • Cycloheptylbromide
  • Cycloheptylbromide,97%
  • DTXCID8036994
  • DTXSID1062386
  • EINECS 219-294-9
  • LC8AX2EKR3
  • LOXORFRCPXUORP-UHFFFAOYSA-N
  • MFCD00004149
  • NSC 9472
  • NSC9472
  • RefChem:121570
  • SCHEMBL625207
  • SCHEMBL9579472
  • bromo-cycloheptan
  • bromo-cycloheptane
  • bromocyclo-heptane

Structure identifiers

Canonical SMILES
BrC1CCCCCC1
Isomeric SMILES
C1CCCC(CC1)Br
InChI
InChI=1S/C7H13Br/c8-7-5-3-1-2-4-6-7/h7H,1-6H2
InChIKey
LOXORFRCPXUORP-UHFFFAOYSA-N
PubChem CID
16992

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 bromocycloheptane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for bromocycloheptane; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record