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Substance Name: 2-Butyne-1,4-diol, bis(4-chloro-2-methylphenoxyacetate)
RN: 14569-74-5
InChIKey: MDDXOTKGUJAELO-UHFFFAOYSA-N

Molecular Formula

  • C22-H20-Cl2-O6

Molecular Weight

  • 451.3
 
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Names and Synonyms

Synonyms

  • 1,4-Bis(2-methyl-4-chlorophenoxyacetoxy)-2-butyne
  • BRN 2316352

Systematic Name

  • 2-Butyne-1,4-diol, bis(4-chloro-2-methylphenoxyacetate)

Registry Numbers

CAS Registry Number

  • 14569-74-5

System Generated Number

  • 0014569745

Structure Descriptors

InChI

1S/C22H20Cl2O6/c1-15-11-17(23)5-7-19(15)29-13-21(25)27-9-3-4-10-28-22(26)14-30-20-8-6-18(24)12-16(20)2/h5-8,11-12H,9-10,13-14H2,1-2H3

InChIKey

MDDXOTKGUJAELO-UHFFFAOYSA-N

Smiles

C(C#CCOC(COc1c(cc(cc1)Cl)C)=O)OC(COc1c(cc(cc1)Cl)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00900,