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Substance Name: Disodium 2-(4-amino-3-sulphonatophenyl)-6-methylbenzothiazole-7-sulphonate
RN: 52044-08-3
InChIKey: HBJCVQUBNWAIAA-UHFFFAOYSA-L

Molecular Formula

  • C14-H12-N2-O6-S3.2Na

Molecular Weight

  • 444.419
 
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Names and Synonyms

Synonym

  • EINECS 257-623-8

Systematic Name

  • Disodium 2-(4-amino-3-sulphonatophenyl)-6-methylbenzothiazole-7-sulphonate

Registry Numbers

CAS Registry Number

  • 52044-08-3

System Generated Number

  • 0052044083

Molecular Formulas

Molecular Formula

  • C14-H12-N2-O6-S3.2Na

Molecular Formula Fragments

  • C14-H12-N2-O6-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H12N2O6S3.2Na/c1-7-2-5-10-12(13(7)25(20,21)22)23-14(16-10)8-3-4-9(15)11(6-8)24(17,18)19;;/h2-6H,15H2,1H3,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2

InChIKey

HBJCVQUBNWAIAA-UHFFFAOYSA-L

Smiles

Cc1ccc2c(c1S(=O)(=O)[O-])sc(n2)c3ccc(c(c3)S(=O)(=O)[O-])N.[Na+].[Na+]