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Substance Name: Isothiocyanic acid, 4-chloro-1-naphthyl ester
RN: 101670-65-9
InChIKey: KMDNKLRJLQTHPA-UHFFFAOYSA-N

Molecular Formula

  • C11-H6-Cl-N-S

Molecular Weight

  • 219.694
 
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Names and Synonyms

Synonyms

  • 3-12-00-02962 (Beilstein Handbook Reference)
  • 4-Chloro-1-naphthylisothiocyanate
  • BRN 3259202

Systematic Name

  • Isothiocyanic acid, 4-chloro-1-naphthyl ester

Registry Numbers

CAS Registry Number

  • 101670-65-9

System Generated Number

  • 0101670659

Structure Descriptors

InChI

1S/C11H6ClNS/c12-10-5-6-11(13-7-14)9-4-2-1-3-8(9)10/h1-6H

InChIKey

KMDNKLRJLQTHPA-UHFFFAOYSA-N

Smiles

c12c(c(ccc1N=C=S)Cl)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#10061,