1,4-Bis(bromomethyl)benzene
Properties
- Molecular formula
- C8H8Br2
- Molar mass
- 263.96 g/mol
- Exact mass
- 261.8993 Da
- Melting point
- 144.5 °C
- Boiling point
- 245 °C
- logP
- 3.48Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Identifiers
CAS number
623-24-5SMILES
BrCc1ccc(CBr)cc1InChIKey
RBZMSGOBSOCYHR-UHFFFAOYSA-NInChI
InChI=1S/C8H8Br2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H,5-6H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- p-Di(bromomethyl)benzene
- Benzene, 1,4-bis(bromomethyl)-
- p-Xylene, α,α′-dibromo-
- p-Xylylene dibromide
- 1,4-Di(bromomethyl)benzene
- α,α′-Dibromo-p-xylene
- p-Bis(bromomethyl)benzene
- p-Xylylene bromide
- α,α′-p-Xylene dibromide
- 1,4-Xylylene dibromide
- 4-Bromomethylbenzyl bromide
- NSC 6226
Work with 1,4-Bis(bromomethyl)benzene
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
4-Bromobenzyl bromide589-15-171 % similar
Benzyl bromide100-39-069 % similar
4-Methylbenzyl bromide104-81-467 % similar
4-Iodobenzyl bromide16004-15-267 % similar
1,1′-Oxybis[4-(bromomethyl)benzene]4542-75-067 % similar
4-Fluorobenzyl bromide459-46-167 % similar
4-Chlorobenzyl bromide622-95-767 % similar
4-Cyanobenzyl bromide17201-43-357 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds