(1,2-Dibromoethyl)benzene
Properties
- Molecular formula
- C8H8Br2
- Molar mass
- 263.96 g/mol
- Exact mass
- 261.8993 Da
- Melting point
- 75 °C
- Boiling point
- 133 °C
- logP
- 3.52Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Hazards
Danger
- H314 Causes severe skin burns and eye damage98.5% of notifiers
Aggregated from 65 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501
Identifiers
CAS number
93-52-7SMILES
BrCC(Br)c1ccccc1InChIKey
SHKKTLSDGJRCTR-UHFFFAOYSA-NInChI
InChI=1S/C8H8Br2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8H,6H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzene, (1,2-dibromoethyl)-
- α,β-Dibromoethylbenzene
- Dowspray 9
- 1,2-Dibromo-2-phenylethane
- 1,2-Dibromo-1-phenylethane
- 1-Phenyl-1,2-dibromoethane
- 1,2-Dibromophenylethane
- Vic-Styrene dibromide
- NSC 62438
Work with (1,2-Dibromoethyl)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
1-Bromo-2-phenylpropane1459-00-354 % similar
meso-Stilbene dibromide13440-24-948 % similar
Bromodiphenylmethane776-74-948 % similar
3,3-Diphenylpropyl bromide20017-68-944 % similar
(1-Bromoethyl)benzene585-71-742 % similar
Phenylcyclopropane873-49-442 % similar
Triphenylmethane519-73-341 % similar
3,3-Diphenylpropylamine5586-73-239 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.