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Substance Name: Barium anilinobenzenesulphonate
RN: 1300-92-1
InChIKey: JWTHKGUPPCYKNI-UHFFFAOYSA-L

Molecular Formula

  • C12-H11-N-O3-S.1/2Ba

Molecular Weight

  • 633.892
 
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Names and Synonyms

Results Name

  • Barium anilinobenzenesulphonate

Synonym

  • EINECS 215-093-5

Systematic Names

  • Barium anilinobenzenesulphonate
  • Benzenesulfonic acid, (phenylamino)-, barium salt
  • Benzenesulfonic acid, (phenylamino)-, barium salt (2:1)

Registry Numbers

CAS Registry Number

  • 1300-92-1

System Generated Number

  • 0001300921

Molecular Formulas

Molecular Formula

  • C12-H11-N-O3-S.1/2Ba

Molecular Formula Fragments

  • Ba
  • C12-H11-N-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/2C12H11NO3S.Ba/c2*14-17(15,16)12-9-5-4-8-11(12)13-10-6-2-1-3-7-10;/h2*1-9,13H,(H,14,15,16);/q;;+2/p-2

InChIKey

JWTHKGUPPCYKNI-UHFFFAOYSA-L

Smiles

[Ba+2].c1(c(Nc2ccccc2)cccc1)S(=O)(=O)[O-].c1(c(cccc1)Nc1ccccc1)S(=O)(=O)[O-]