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Substance Name: Propanimidoyl chloride, N-(((diethylamino)carbonyl)oxy)-, compd. with calcium chloride (1:1)
RN: 171199-17-0
InChIKey: MATNAHPEGGTCRY-SULXSYCDSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H15-Cl-N2-O2.Ca-Cl2

Molecular Weight

  • 317.6555
 
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Names and Synonyms

Synonym

  • N-(((Diethylamino)carbonyl)oxy)propanimidoyl chloride compd. with calcium chloride (1:1)

Systematic Name

  • Propanimidoyl chloride, N-(((diethylamino)carbonyl)oxy)-, compd. with calcium chloride (1:1)

Registry Numbers

CAS Registry Number

  • 171199-17-0

System Generated Number

  • 0171199170

Molecular Formulas

Molecular Formula

  • C8-H15-Cl-N2-O2.Ca-Cl2

Molecular Formula Fragments

  • C8-H15-Cl-N2-O2
  • Ca-Cl2
  • COMPONENT

Structure Descriptors

InChI

1S/C8H15ClN2O2.Ca.2ClH/c1-4-7(9)10-13-8(12)11(5-2)6-3;;;/h4-6H2,1-3H3;;2*1H/q;+2;;/p-2/b10-7-;;;

InChIKey

MATNAHPEGGTCRY-SULXSYCDSA-L

Smiles

CC/C(=N/OC(=O)N(CC)CC)/Cl.[Cl-].[Cl-].[Ca+2]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 535mg/kg (535mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 23, 1995.