chempirical

1,3-Dibromobenzene

C6H4Br2CAS 108-36-1235.91 g/mol

Open in Covalent MOL file
BrBr
Aryl halide

Properties

Molecular formula
C6H4Br2
Molar mass
235.91 g/mol
Exact mass
233.8680 Da
Density
1.9523 g/mL (at 20.4 °C)
Melting point
−7 °C
Boiling point
218 °C
logP
3.21Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
108-36-1
SMILES
Brc1cccc(Br)c1
InChIKey
JSRLURSZEMLAFO-UHFFFAOYSA-N
InChI
InChI=1S/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4H

Weigh it out

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

Names and synonyms

4 names
  • Benzene, 1,3-dibromo-
  • Benzene, m-dibromo-
  • m-Dibromobenzene
  • 1-Bromo-3-bromobenzene

Work with 1,3-Dibromobenzene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Bromo-3-fluorobenzene1073-06-963 % similar 1-Bromo-3-chlorobenzene108-37-263 % similar 3-Bromobiphenyl2113-57-760 % similar 3-Bromotoluene591-17-360 % similar 1-Bromo-3-iodobenzene591-18-460 % similar 3-Bromoaniline591-19-560 % similar 3-Bromophenol591-20-860 % similar 3-Bromothiophenol6320-01-060 % similar

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

Same formula

1,4-Dibromobenzene106-37-6 1,2-Dibromobenzene583-53-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook