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Substance Name: Hydrogen (5-chloro-3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxybenzene-1-sulphonato(3-))hydroxychromate(1-) , compound with 2-aminoethanol (1:1)
RN: 85443-62-5
InChIKey: WITSWDGLILLILQ-HRBIVCMLSA-L

Molecular Formula

  • C16-H11-Cl-Cr-N4-O6-S.C2-H7-N-O.H

Molecular Weight

  • 536.8911
 
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Names and Synonyms

Synonym

  • EINECS 287-253-2

Systematic Name

  • Hydrogen (5-chloro-3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxybenzene-1-sulphonato(3-))hydroxychromate(1-) , compound with 2-aminoethanol (1:1)

Registry Numbers

CAS Registry Number

  • 85443-62-5

System Generated Number

  • 0085443625

Molecular Formulas

Molecular Formula

  • C16-H11-Cl-Cr-N4-O6-S.C2-H7-N-O.H

Molecular Formula Fragments

  • C16-H11-Cl-Cr-N4-O6-S
  • C2-H7-N-O
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C16H12ClN4O5S.C2H7NO.Cr.H2O/c1-9-14(16(23)21(20-9)11-5-3-2-4-6-11)19-18-12-7-10(17)8-13(15(12)22)27(24,25)26;3-1-2-4;;/h2-8,22H,1H3,(H,24,25,26);4H,1-3H2;;1H2/q;;+2;/p-2/b19-18+;;;

InChIKey

WITSWDGLILLILQ-HRBIVCMLSA-L

Smiles

CC1=NN(C(=O)C12N=Nc3cc(Cl)cc4c3O[Cr-]2(O)OS4(=O)=O)c5ccccc5.NCCO