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Substance Name: 1,1,1-Trichloro-2,2-diphenylethane
RN: 2971-22-4
UNII: DCE98CK2EW
InChIKey: ZADGQTHIZZOKGE-UHFFFAOYSA-N

Molecular Formula

  • C14-H11-Cl3

Molecular Weight

  • 285.6
 
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Names and Synonyms

Name of Substance

  • 1,1,1-Trichloro-2,2-diphenylethane

Synonyms

  • 1,1'-(2,2,2-Trichloroethylidene)dibenzene
  • 1,1,1-Trichloro-2,2-diphenylethane
  • 1,1-Diphenyl-2,2,2-trichloroethane
  • 2,2-Diphenyl-1,1,1-trichloroethane
  • 4-05-00-01882 (Beilstein Handbook Reference)
  • AI3-01842
  • Benzene, 1,1'-(2,2,2-trichloroethylidene)bis-
  • BRN 1963701
  • Diphenyltrichloroethane
  • DPE
  • DPHDT
  • DPT (VAN)
  • DPT [Pesticide]
  • EINECS 221-007-7
  • Ethane, 1,1,1-trichloro-2,2-diphenyl-
  • Ethane, 2,2-diphenyl-1,1,1-trichloro-
  • HSDB 5908
  • NSC 4181
  • UNII-DCE98CK2EW

Systematic Names

  • 1,1'-(2,2,2-Trichloroethylidene)dibenzene
  • Benzene, 1,1'-(2,2,2-trichloroethylidene)bis-
  • Ethane, 1,1,1-trichloro-2,2-diphenyl- (8CI)
  • Ethane, 2,2-diphenyl-1,1,1-trichloro-

Registry Numbers

CAS Registry Number

  • 2971-22-4

FDA UNII

  • DCE98CK2EW

System Generated Number

  • 0002971224

Structure Descriptors

InChI

1S/C14H11Cl3/c15-14(16,17)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H

InChIKey

ZADGQTHIZZOKGE-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(c1ccccc1)C(Cl)(Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg) BEHAVIORAL: TREMOR Helvetica Chimica Acta. Vol. 29, Pg. 1317, 1946.
rat LDLo oral 1gm/kg (1000mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 88, Pg. 359, 1946.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.87 (none)   EXP
Water Solubility 1.030 mg/L 25 EST
Vapor Pressure 8.99E-05 mm Hg 25 EST
Henry's Law Constant 2.79E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.39E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.