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Substance Name: 3-Pyridinecarboxylic acid, 2-((phenylmethyl)thio)-
RN: 112811-90-2
InChIKey: OJNZDGDYAXCHPB-UHFFFAOYSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C13-H11-N-O2-S

Molecular Weight

  • 245.3009
 
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Names and Synonyms

  • 3-Pyridinecarboxylic acid, 2-((phenylmethyl)thio)-

Registry Numbers

CAS Registry Number

  • 112811-90-2

System Generated Number

  • 0112811902

Structure Descriptors

InChI

1S/C13H11NO2S/c15-13(16)11-7-4-8-14-12(11)17-9-10-5-2-1-3-6-10/h1-8H,9H2,(H,15,16)

InChIKey

OJNZDGDYAXCHPB-UHFFFAOYSA-N

Smiles

OC(=O)c1cccnc1SCc2ccccc2