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Molecule record

1-bromo-4-propan-2-ylbenzene

C9H11Br

199.09 g/mol

Loading structure

Molecular properties

Formula
C9H11Br
Molar mass
199.09 g·mol−1
Exact mass
198.0044 Da
4
PubChem CID
11462

Functional groups

Alkane / alkyl carbon
Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 1-Bromo-4-isopropylbenzene
  • 2(4Bromophenyl)propane
  • 2(pBromophenyl)propane
  • 4-Bromocumene
  • 4-Bromoisopropylbenzene
  • 4-Isopropylbromobenzene
  • 4Bromocumene
  • 4Isopropylbromobenzene
Show all 24 synonyms
  • 586-61-8
  • Benzene, 1-bromo-4-(1-methylethyl)-
  • Benzene, 1bromo4(1methylethyl)
  • Cumene, p-bromo-
  • Cumene, pbromo
  • Cumene, pbromo (8CI)
  • DTXCID2042438
  • DTXSID7060411
  • EINECS 209-577-5
  • MOZHUOIQYVYEPN-UHFFFAOYSA-N
  • NSC 97223
  • RefChem:75133
  • p-Bromocumene
  • p-Bromoisopropylbenzene
  • pBromocumene
  • pBromoisopropylbenzene

Structure identifiers

Canonical SMILES
CC(C)c1ccc(Br)cc1
Isomeric SMILES
CC(C)C1=CC=C(C=C1)Br
InChI
InChI=1S/C9H11Br/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,1-2H3
InChIKey
MOZHUOIQYVYEPN-UHFFFAOYSA-N
PubChem CID
11462

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-bromo-4-propan-2-ylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-bromo-4-propan-2-ylbenzene; not experimental data.

Sources

Molecule identity

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

PubChem(link only)
Open source record