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Substance Name: Pyrylium, 4-benzylthio-2,6-dimethyl-, iodide
RN: 74332-95-9
InChIKey: LWPHDTLWKPLISC-UHFFFAOYSA-M

Molecular Formula

  • C14-H15-O-S.I

Molecular Weight

  • 358.2375
 
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Names and Synonyms

Synonyms

  • 2,6-Dimethyl-4-benzylmercaptopyrylium iodide
  • NSC 36466

Systematic Names

  • Pyrylium, 2,6-dimethyl-4-((phenylmethyl)thio)-, iodide (9CI)
  • Pyrylium, 4-benzylthio-2,6-dimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 74332-95-9

System Generated Number

  • 0074332959

Molecular Formulas

Molecular Formula

  • C14-H15-O-S.I

Molecular Formula Fragments

  • C14-H15-O-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C14H15OS.HI/c1-11-8-14(9-12(2)15-11)16-10-13-6-4-3-5-7-13;/h3-9H,10H2,1-2H3;1H/q+1;/p-1

InChIKey

LWPHDTLWKPLISC-UHFFFAOYSA-M

Smiles

Cc1cc(cc([o+]1)C)SCc2ccccc2.[I-]

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#01765,