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Substance Name: Acrolein, 2,3,3-trichloro-
RN: 3787-28-8
InChIKey: ZLWJEEVJKLGSRT-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C3-H-Cl3-O

Molecular Weight

  • 159.399
 
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Names and Synonyms

Synonyms

  • 2,3,3-Trichloro-2-propenal
  • 2,3,3-Trichloroacrolein
  • 2,3,3-Trichloropropenal
  • 4-01-00-03441 (Beilstein Handbook Reference)
  • BRN 1745438
  • CCRIS 7473

Systematic Names

  • 2,3,3-Trichloropropenal
  • 2-Propenal, 2,3,3-trichloro- (9CI)
  • Acrolein, 2,3,3-trichloro-

Registry Numbers

CAS Registry Number

  • 3787-28-8

System Generated Number

  • 0003787288

Structure Descriptors

InChI

1S/C3HCl3O/c4-2(1-7)3(5)6/h1H

InChIKey

ZLWJEEVJKLGSRT-UHFFFAOYSA-N

Smiles

C(=C(/Cl)Cl)(\C=O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 4mg/kg (4mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 30, Pg. 627, 1982.