1,4-Bis(trichloromethyl)benzene
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
Identifiers
CAS number
68-36-0SMILES
ClC(Cl)(Cl)c1ccc(C(Cl)(Cl)Cl)cc1InChIKey
OTEKOJQFKOIXMU-UHFFFAOYSA-NInChI
InChI=1S/C8H4Cl6/c9-7(10,11)5-1-2-6(4-3-5)8(12,13)14/h1-4HWeigh it out
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