1,3-Bis(dibromomethyl)benzene

C8H6Br4CAS 36323-28-1421.75 g/mol

Open in Covalent MOL file
BrBrBrBr
Alkyl halide

Properties

Molecular formula
C8H6Br4
Molar mass
421.75 g/mol
Exact mass
417.7203 Da
Melting point
107 °C
logP
5.26Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, P501

Identifiers

CAS number
36323-28-1
SMILES
BrC(Br)c1cccc(C(Br)Br)c1
InChIKey
ZMCUKNMLHBAGMS-UHFFFAOYSA-N
InChI
InChI=1S/C8H6Br4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,7-8H

Weigh it out

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Names and synonyms

4 names
  • Benzene, 1,3-bis(dibromomethyl)-
  • m-Xylene, α,α,α′,α′-tetrabromo-
  • α,α,α′,α′-Tetrabromo-m-xylene
  • NSC 76079

Work with 1,3-Bis(dibromomethyl)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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3-Diisopropylbenzene99-62-745 % similar meso-Stilbene dibromide13440-24-941 % similar Bromodiphenylmethane776-74-941 % similar (1-Bromoethyl)benzene585-71-736 % similar 3-Bromocumene5433-01-236 % similar (1,2-Dibromoethyl)benzene93-52-735 % similar Triphenylmethane519-73-333 % similar (1S)-1-(3-Bromophenyl)ethan-1-ol134615-22-832 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Tetrabromo-O-xylene13209-15-9 1,4-Bis(dibromomethyl)benzene1592-31-0 2,3,5,6-Tetrabromo-p-xylene23488-38-2 1,4-Dibromo-2,5-bis(bromomethyl)benzene35335-16-1

Elsewhere

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