Cas no 31904-18-4 (Benzene,dichloro(trichloromethyl)-)

Benzene,dichloro(trichloromethyl)- structure
31904-18-4 structure
Product Name:Benzene,dichloro(trichloromethyl)-
CAS No:31904-18-4
MF:C7H3CL5
MW:264.3637
CID:314146
Update Time:2024-01-28

Benzene,dichloro(trichloromethyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzene,dichloro(trichloromethyl)-
    • 1,2-dichloro-3-(trichloromethyl)benzene
    • 1,2-dichloro-4-(trichloromethyl)benzene
    • alpha,alpha,alpha,ar,ar-Pentachlorotoluene
    • Dichlorobenzotrichloride
    • Toluene, alpha,alpha,alpha,ar,ar-pentachloro-
    • α,α,α,ar,ar-Pentachlorotoluene
    • Benzene, dichloro(trichloromethyl)-
    • Einecs 250-861-3
    • Inchi: InChI=1S/C7H3Cl5/c8-5-3-1-2-4(6(5)9)7(10,11)12/h1-3H
    • InChI Key: GKGPLSQWIBJJPC-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=C(C(Cl)(Cl)Cl)C=1Cl

Computed Properties

  • Exact Mass: 263.864789
  • Monoisotopic Mass: 261.867739
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 152
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0

Experimental Properties

  • Density: 1.605
  • Boiling Point: 283.1°Cat760mmHg
  • Flash Point: 123.5°C
  • Refractive Index: 1.583
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