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Substance Name: Chromate(3-), bis(2-(2-(4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)benzoato(3-))-, hydrogen, compd. with N-cyclohexylcyclohexanamine (1:3:2)
RN: 63982-58-1
InChIKey: KFYWGRMPGNSCEB-CKOIWFHQSA-M

Molecular Formula

  • C34-H22-Cr-N8-O12-S2.2C12-H23-N.3H

Molecular Weight

  • 1216.38
 
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Names and Synonyms

Synonym

  • EINECS 264-591-9

Systematic Names

  • Chromate(3-), bis(2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)azo)benzoato(3-))-, trihydrogen, compd. with N-cyclohexylcyclohexanamine (1:2)
  • Chromate(3-), bis(2-(2-(4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)benzoato(3-))-, hydrogen, compd. with N-cyclohexylcyclohexanamine (1:3:2)
  • Trihydrogen bis(2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-pyrazol-4-yl)azo)benzoato(3-))chromate(3-), compound with dicyclohexylamine (1:2)

Registry Numbers

CAS Registry Number

  • 63982-58-1

System Generated Number

  • 0063982581

Molecular Formulas

Molecular Formula

  • C34-H22-Cr-N8-O12-S2.2C12-H23-N.3H

Molecular Formula Fragments

  • C12-H23-N
  • C34-H22-Cr-N8-O12-S2
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/2C17H13N4O6S.2C12H23N.Cr/c2*1-10-15(19-18-14-5-3-2-4-13(14)17(23)24)16(22)21(20-10)11-6-8-12(9-7-11)28(25,26)27;2*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h2*2-9H,1H3,(H,23,24)(H,25,26,27);2*11-13H,1-10H2;/q2*-1;;;+3/p-1/b2*19-18+;;;

InChIKey

KFYWGRMPGNSCEB-CKOIWFHQSA-M

Smiles

C1(CCCCC1)NC1CCCCC1.S(=O)(=O)(c1ccc(N2C([C@@-](\N=N\c3ccccc3C([O-])=O)C(=N2)C)=O)cc1)[O-].[Cr+3].S(c1ccc(cc1)N1C([C@@-](C(=N1)C)\N=N\c1ccccc1C([O-])=O)=O)([O-])(=O)=O.C1(CCCCC1)NC1CCCCC1