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Substance Name: Butanimidoyl chloride, N-(((dimethylamino)carbonyl)oxy)-, compd. with calcium chloride (1:1)
RN: 171199-18-1
InChIKey: VKAIQRIAOPFWPT-CPNIPSBZSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H13-Cl-N2-O2

Molecular Weight

  • 303.6287
 
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Names and Synonyms

Synonym

  • N-(((Dimethylamino)carbonyl)oxy)butanimidoyl chloride compd. with calcium chloride (1:1)

Systematic Name

  • Butanimidoyl chloride, N-(((dimethylamino)carbonyl)oxy)-, compd. with calcium chloride (1:1)

Registry Numbers

CAS Registry Number

  • 171199-18-1

System Generated Number

  • 0171199181

Structure Descriptors

InChI

1S/C7H13ClN2O2.Ca.2ClH/c1-4-5-6(8)9-12-7(11)10(2)3;;;/h4-5H2,1-3H3;;2*1H/q;+2;;/p-2/b9-6-;;;

InChIKey

VKAIQRIAOPFWPT-CPNIPSBZSA-L

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 250mg/kg (250mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 23, 1995.