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Substance Name: 1,1,3,3-Tetrachloroacetone
RN: 632-21-3
UNII: J7R42FF17P
InChIKey: DJWVKJAGMVZYFP-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Reproductive Effect

Molecular Formula

  • C3-H2-Cl4-O

Molecular Weight

  • 195.86
 
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Names and Synonyms

Name of Substance

  • 1,1,3,3-Tetrachloroacetone

Synonyms

  • 1,1,3,3-Tetrachloro-2-propanone
  • 1,1,3,3-Tetrachloroacetone
  • 1,1,3,3-Tetrachloropropanone
  • 4-01-00-03222 (Beilstein Handbook Reference)
  • BRN 1754083
  • CCRIS 7471
  • EINECS 211-172-3
  • NSC 137844
  • Tetrachloroacetone
  • UNII-J7R42FF17P

Systematic Names

  • 1,1,3,3-Tetrachloroacetone
  • 1,1,3,3-Tetrachloropropanone
  • 2-Propanone, 1,1,3,3-tetrachloro-

Registry Numbers

CAS Registry Number

  • 632-21-3

FDA UNII

  • J7R42FF17P

System Generated Number

  • 0000632213

Structure Descriptors

InChI

1S/C3H2Cl4O/c4-2(5)1(8)3(6)7/h2-3H

InChIKey

DJWVKJAGMVZYFP-UHFFFAOYSA-N

Smiles

C(C(Cl)Cl)(C(Cl)Cl)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 176mg/kg (176mg/kg)   Fundamental and Applied Toxicology. Vol. 2, Pg. 220, 1982.
rabbit LD50 skin 80mg/kg (80mg/kg)   Fundamental and Applied Toxicology. Vol. 2, Pg. 220, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 183 deg C   EXP
log P (octanol-water) 0.630 (none)   EST
Atmospheric OH Rate Constant 2.24E-13 cm3/molecule-sec 25 EST

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