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Substance Name: 2-Propenethioic acid, 3-(4-methoxy-3-propoxyphenyl)-, O-ethyl ester
RN: 117666-85-0
InChIKey: VFRJDRWMWFPRRY-VQHVLOKHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-O3-S

Molecular Weight

  • 280.386
 
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Names and Synonyms

Synonyms

  • 3-(4-Methoxy-3-propoxyphenyl)-2-propenethioic acid O-ethyl ester
  • 3-(4-Metossi-3-propossifenil)prop-2-entionoetilestere
  • 3-(4-Metossi-3-propossifenil)prop-2-entionoetilestere [Italian]
  • Cinnamic acid, (4-methoxy-3-propoxy)thio-, O-ethyl ester

Systematic Name

  • 2-Propenethioic acid, 3-(4-methoxy-3-propoxyphenyl)-, O-ethyl ester

Registry Numbers

CAS Registry Number

  • 117666-85-0

System Generated Number

  • 0117666850

Structure Descriptors

InChI

1S/C15H20O3S/c1-4-10-18-14-11-12(6-8-13(14)16-3)7-9-15(19)17-5-2/h6-9,11H,4-5,10H2,1-3H3/b9-7+

InChIKey

VFRJDRWMWFPRRY-VQHVLOKHSA-N

Smiles

CCCOc1cc(ccc1OC)/C=C/C(=S)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 970mg/kg (970mg/kg)   Farmaco, Edizione Scientifica. Vol. 43, Pg. 551, 1988.