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Substance Name: Benzene, 1-methoxy-4-(1-(phenylthio)butyl)-
RN: 60702-17-2
InChIKey: PJQVDTJIZNYTEX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-O-S

Molecular Weight

  • 272.41
 
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Names and Synonyms

Synonyms

  • 1-(4-Methoxyphenyl)-1-phenylthiobutane
  • Anisole, p-(1-(phenylthio)butyl)-
  • BRN 1914599
  • Butane, 1-(4-methoxyphenyl)-1-phenylthio-

Systematic Name

  • Benzene, 1-methoxy-4-(1-(phenylthio)butyl)-

Registry Numbers

CAS Registry Number

  • 60702-17-2

System Generated Number

  • 0060702172

Structure Descriptors

InChI

1S/C17H20OS/c1-3-7-17(19-16-8-5-4-6-9-16)14-10-12-15(18-2)13-11-14/h4-6,8-13,17H,3,7H2,1-2H3

InChIKey

PJQVDTJIZNYTEX-UHFFFAOYSA-N

Smiles

CCCC(c1ccc(cc1)OC)Sc2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Pharmaceutical Chemistry Journal Vol. 13, Pg. 494, 1979.