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Substance Name: Nicotinic acid, 2-(ethylthio)ethyl ester
RN: 27868-70-8
InChIKey: YYHAPAOVKCWFIA-UHFFFAOYSA-N

Molecular Formula

  • C10-H13-N-O2-S

Molecular Weight

  • 211.284
 
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Names and Synonyms

Synonyms

  • 2-(Ethylthio)ethyl nicotinate
  • 5-22-05-00108 (Beilstein Handbook Reference)
  • BRN 0389736

Systematic Name

  • Nicotinic acid, 2-(ethylthio)ethyl ester

Registry Numbers

CAS Registry Number

  • 27868-70-8

System Generated Number

  • 0027868708

Structure Descriptors

InChI

1S/C10H13NO2S/c1-2-14-7-6-13-10(12)9-4-3-5-11-8-9/h3-5,8H,2,6-7H2,1H3

InChIKey

YYHAPAOVKCWFIA-UHFFFAOYSA-N

Smiles

c1(C(OCCSCC)=O)cccnc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 500mg/kg (500mg/kg)   Pharmazie. Vol. 11, Pg. 242, 1956.