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Substance Name: Benzene, 1-methoxy-4-(1-(phenylthio)hexyl)-
RN: 60702-20-7
InChIKey: NYMNGKZIFGYQIE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-O-S

Molecular Weight

  • 300.4636
 
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Names and Synonyms

Synonyms

  • 1-(4-Methoxyphenyl)-1-phenylthiohexane
  • Anisole, p-(1-(phenylthio)hexyl)-
  • BRN 1915297
  • Hexane, 1-(4-methoxyphenyl)-1-phenylthio-

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 60702-20-7

System Generated Number

  • 0060702207

Structure Descriptors

InChI

1S/C19H24OS/c1-3-4-6-11-19(21-18-9-7-5-8-10-18)16-12-14-17(20-2)15-13-16/h5,7-10,12-15,19H,3-4,6,11H2,1-2H3

InChIKey

NYMNGKZIFGYQIE-UHFFFAOYSA-N

Smiles

CCCCCC(c1ccc(cc1)OC)Sc2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg) BEHAVIORAL: GENERAL ANESTHETIC Pharmaceutical Chemistry Journal Vol. 13, Pg. 494, 1979.