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Substance Name: Isocyanic acid, 3-bromoallyl ester
RN: 101652-13-5
InChIKey: FSSOZQYOMJZDRW-OWOJBTEDSA-N

Molecular Formula

  • C4-H4-Br-N-O

Molecular Weight

  • 161.986
 
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Names and Synonyms

Synonym

  • 3-Bromoallyl isocyanate

Systematic Name

  • Isocyanic acid, 3-bromoallyl ester

Registry Numbers

CAS Registry Number

  • 101652-13-5

System Generated Number

  • 0101652135

Structure Descriptors

InChI

1S/C4H4BrNO/c5-2-1-3-6-4-7/h1-2H,3H2/b2-1+

InChIKey

FSSOZQYOMJZDRW-OWOJBTEDSA-N

Smiles

C(\C=C\Br)N=C=O

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#09998,