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Substance Name: 1,2-Diacetoxy-3-chloropropane
RN: 869-50-1
UNII: M3N2W05GUP
InChIKey: GTFUGSXMTMYKRG-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C7-H11-Cl-O4

Molecular Weight

  • 194.613
 
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Names and Synonyms

Name of Substance

  • 1,2-Diacetoxy-3-chloropropane

Synonyms

  • 1,2-Diacetoxy-3-chloropropane
  • 1,2-Ethanediol, 1-chloromethyl-, diacetate
  • 1-Chloro-2,3-diacetoxypropane
  • 1-Chloro-2,3-propanediol diacetate
  • 1-Chloromethyl-1,2-ethanediol diacetate
  • 3-02-00-00313 (Beilstein Handbook Reference)
  • 3-Chloro-1,2-diacetoxypropane
  • Acetic acid, 3-chloropropylene ester
  • AI3-32152
  • alpha-Chlorohydrin diacetate
  • BRN 0879152
  • Chlorodeoxyglycerol diacetate
  • NSC 13880
  • NSC 44718
  • UNII-M3N2W05GUP

Systematic Name

  • 1,2-Propanediol, 3-chloro-, diacetate

Registry Numbers

CAS Registry Number

  • 869-50-1

FDA UNII

  • M3N2W05GUP

System Generated Number

  • 0000869501

Structure Descriptors

InChI

1S/C7H11ClO4/c1-5(9)11-4-7(3-8)12-6(2)10/h7H,3-4H2,1-2H3

InChIKey

GTFUGSXMTMYKRG-UHFFFAOYSA-N

Smiles

C(O[C@@H](COC(=O)C)CCl)(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 340mg/kg (340mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 644, 1977.