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Substance Name: Sulfide, butyl beta-chlorophenethyl
RN: 21851-41-2
InChIKey: HQSLLSAIKQYICT-UHFFFAOYSA-N

Molecular Formula

  • C12-H17-Cl-S

Molecular Weight

  • 228.785
 
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Names and Synonyms

Synonyms

  • 4-06-00-03093 (Beilstein Handbook Reference)
  • BRN 2329242
  • Butyl beta-chlorophenethyl sulfide

Systematic Name

  • Sulfide, butyl beta-chlorophenethyl

Registry Numbers

CAS Registry Number

  • 21851-41-2

System Generated Number

  • 0021851412

Structure Descriptors

InChI

1S/C12H17ClS/c1-2-3-9-14-10-12(13)11-7-5-4-6-8-11/h4-8,12H,2-3,9-10H2,1H3

InChIKey

HQSLLSAIKQYICT-UHFFFAOYSA-N

Smiles

S(C[C@@H](c1ccccc1)Cl)CCCC

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#05552,