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Substance Name: 2-Thioisocoumarin
RN: 5962-03-8
UNII: 2KN5BC1OE4
InChIKey: CNUDDOHXAPFILY-UHFFFAOYSA-N

Molecular Formula

  • C9-H6-O-S

Molecular Weight

  • 162.2114
 
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Names and Synonyms

Name of Substance

  • 2-Thioisocoumarin

Synonyms

  • Isothiocoumarin
  • NSC 404000
  • UNII-2KN5BC1OE4

Systematic Name

  • 1H-Isothiochromen-1-one

Registry Numbers

CAS Registry Number

  • 5962-03-8

FDA UNII

  • 2KN5BC1OE4

System Generated Number

  • 0005962038

Structure Descriptors

InChI

1S/C9H6OS/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H

InChIKey

CNUDDOHXAPFILY-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)ccsc2=O