1,4-Bis(trichloromethyl)benzene

C8H4Cl6CAS 68-36-0312.82 g/mol

Open in Covalent MOL file
ClClClClClCl
Alkyl halide

Properties

Molecular formula
C8H4Cl6
Molar mass
312.82 g/mol
Exact mass
309.8444 Da
Density
1.78 g/mL
Melting point
108–110 °C
Boiling point
213 °C
logP
5.34Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Acute Toxic (GHS06)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P403+P233, P405, P501

Identifiers

CAS number
68-36-0
SMILES
ClC(Cl)(Cl)c1ccc(C(Cl)(Cl)Cl)cc1
InChIKey
OTEKOJQFKOIXMU-UHFFFAOYSA-N
InChI
InChI=1S/C8H4Cl6/c9-7(10,11)5-1-2-6(4-3-5)8(12,13)14/h1-4H

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

Names and synonyms

22 names · show all
  • Benzene, 1,4-bis(trichloromethyl)-
  • p-Xylene, α,α,α,α′,α′,α′-hexachloro-
  • Chloxyl
  • Hetol
  • p-Bis(trichloromethyl)benzene
  • Bitriben
  • α,α,α,α′,α′,α′-Hexachloro-p-xylene
  • ω,ω′-Hexachloro-p-xylene
  • ω-Hexachloro-p-xylene
  • p-Bis(perchloromethyl)benzene
  • 1,4-Di(Trichloromethyl)benzene
  • Hexachloroparaxylol
  • Chloksil
  • Cloxil
  • Chloxil
  • Khloxil
  • Hexachloroxylene
  • Hexichol
  • NSC 41883
  • Geksol
  • Chloxyle
  • Polytrem

Work with 1,4-Bis(trichloromethyl)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-Chlorobenzotrichloride5216-25-171 % similar Benzotrichloride98-07-769 % similar 1-Fluoro-4-(trichloromethyl)benzene402-42-667 % similar 1,2-Dichloro-4-(trichloromethyl)benzene13014-24-952 % similar 2-Chloro-5-trichloromethylpyridine69045-78-948 % similar 1-Fluoro-3-(trichloromethyl)benzene401-77-443 % similar 1-(Trichloromethyl)-3-(trifluoromethyl)benzene16766-90-842 % similar Diphenyldichloromethane2051-90-335 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,3-Bis(trichloromethyl)benzene881-99-2

Elsewhere

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