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Substance Name: Thiocyanic acid, 3-bromoallyl ester
RN: 102367-27-1
InChIKey: FKXFKGRLGSKMOZ-OWOJBTEDSA-N

Molecular Formula

  • C4-H4-Br-N-S

Molecular Weight

  • 178.0526
 
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Names and Synonyms

Synonyms

  • 3-Bromoallylthiocyanate
  • Thiocyanic acid, 3-bromo-2-propenyl ester

Systematic Name

  • Thiocyanic acid, 3-bromoallyl ester

Registry Numbers

CAS Registry Number

  • 102367-27-1

System Generated Number

  • 0102367271

Structure Descriptors

InChI

1S/C4H4BrNS/c5-2-1-3-7-4-6/h1-2H,3H2/b2-1+

InChIKey

FKXFKGRLGSKMOZ-OWOJBTEDSA-N

Smiles

C(\C=C\Br)SC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#09963,