chempirical

1-Bromo-4-cyclohexylbenzene

C12H15BrCAS 25109-28-8239.16 g/mol

Open in Covalent MOL file
Br
Aryl halide

Properties

Molecular formula
C12H15Br
Molar mass
239.16 g/mol
Exact mass
238.0357 Da
Density
1.288 g/mL (at 18 °C)
Boiling point
153–155 °C (at 9 Torr)
logP
4.50Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
25109-28-8
SMILES
Brc1ccc(C2CCCCC2)cc1
InChIKey
LVIJLEREXMVRAN-UHFFFAOYSA-N
InChI
InChI=1S/C12H15Br/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h6-10H,1-5H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names
  • Benzene, 1-bromo-4-cyclohexyl-
  • Cyclohexane, (p-bromophenyl)-
  • 4-Cyclohexylbromobenzene
  • 4-Bromocyclohexylbenzene
  • p-Bromocyclohexylbenzene
  • NSC 67355
  • (4-Bromophenyl)cyclohexane

Work with 1-Bromo-4-cyclohexylbenzene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Bromo-4-cyclopropylbenzene1124-14-777 % similar 1,4-Dicyclohexylbenzene1087-02-171 % similar 4-Cyclohexylphenol1131-60-862 % similar 1-Bromo-4-(trans-4-pentylcyclohexyl)benzene79832-89-659 % similar 4-Cyclohexylbenzenamine6373-50-856 % similar 1-Bromo-4-(trans-4-propylcyclohexyl)benzene86579-53-555 % similar 1-(4-Cyclohexylphenyl)ethanone18594-05-345 % similar 4-Cyclohexylbenzoic acid20029-52-145 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook