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Substance Name: 2(3H)-Furanone, 3-((butylthio)methyl)-5-pentyl-
RN: 120388-36-5
InChIKey: ICARFUGLDOVGDJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H24-O2-S

Molecular Weight

  • 256.4076
 
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Names and Synonyms

Synonyms

  • 3-((Butylthio)methyl)-5-pentyl-2(3H)-furanone
  • BRN 3544813

Systematic Name

  • 2(3H)-Furanone, 3-((butylthio)methyl)-5-pentyl-

Registry Numbers

CAS Registry Number

  • 120388-36-5

System Generated Number

  • 0120388365

Structure Descriptors

InChI

1S/C14H24O2S/c1-3-5-7-8-13-10-12(14(15)16-13)11-17-9-6-4-2/h10,12H,3-9,11H2,1-2H3

InChIKey

ICARFUGLDOVGDJ-UHFFFAOYSA-N

Smiles

CCCCCC1=CC(C(=O)O1)CSCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 280mg/kg (280mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 147, 1989.