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Substance Name: Carbanilic acid, p-ethoxy-, 4-thiocyanato-2-butynyl ester
RN: 14225-21-9
InChIKey: ADIPIHXKOGFBPH-UHFFFAOYSA-N

Molecular Formula

  • C14-H14-N2-O3-S

Molecular Weight

  • 290.342
 
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Names and Synonyms

Synonyms

  • 4-Thiocyanato-2-butynyl-p-ethoxycarbanilate
  • BRN 2755702
  • p-Ethoxycarbanilic acid 4-thiocyanato-2-butynyl ester

Systematic Name

  • Carbanilic acid, p-ethoxy-, 4-thiocyanato-2-butynyl ester

Registry Numbers

CAS Registry Number

  • 14225-21-9

System Generated Number

  • 0014225219

Structure Descriptors

InChI

1S/C14H14N2O3S/c1-2-18-13-7-5-12(6-8-13)16-14(17)19-9-3-4-10-20-11-15/h5-8H,2,9-10H2,1H3,(H,16,17)

InChIKey

ADIPIHXKOGFBPH-UHFFFAOYSA-N

Smiles

c1(ccc(OCC)cc1)NC(OCC#CCSC#N)=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#03009,