1,3′-Bipyridinium, 5′,5′′′-[1,2-ethanediylbis(4,1-phenylene-2,1-diazenediyl)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-, 2-hydroxypropanate (1:2)

CAS Registry Number®

71032-99-0

CAS Name

1,3′-Bipyridinium, 5′,5′′′-[1,2-ethanediylbis(4,1-phenylene-2,1-diazenediyl)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-, 2-hydroxypropanate (1:2)

Molecular Formula

C36H32N8O4.2C3H5O3

Cite this Page

1,3′-Bipyridinium, 5′,5′′′-[1,2-ethanediylbis(4,1-phenylene-2,1-diazenediyl)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-, 2-hydroxypropanate (1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71032-99-0 (retrieved 2024-11-06) (CAS RN: 71032-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H30N8O4.C3H6O3/c1-23-29(33(45)37-35(47)31(23)43-19-5-3-6-20-43)41-39-27-15-11-25(12-16-27)9-10-26-13-17-28(18-14-26)40-42-30-24(2)32(36(48)38-34(30)46)44-21-7-4-8-22-44;1-2(4)3(5)6/h3-8,11-22H,9-10H2,1-2H3,(H2-2,37,38,39,40,45,46,47,48);2,4H,1H3,(H,5,6)/p+1

InChIKey

InChIKey=WCCOOQRFSHXHAM-UHFFFAOYSA-O

SMILES

CC1=C(C(=O)NC(O)=C1N=NC2=CC=C(CCC3=CC=C(N=NC4=C(C)C(=C(O)NC4=O)[N+]=5C=CC=CC5)C=C3)C=C2)[N+]=6C=CC=CC6.C(C([O-])=O)(C)O

Canonical SMILES

O=C([O-])C(O)C.O=C1NC(O)=C(C(=C1N=NC2=CC=C(C=C2)CCC3=CC=C(N=NC4=C(O)NC(=O)C(=C4C)[N+]=5C=CC=CC5)C=C3)C)[N+]=6C=CC=CC6

Other Names for this Substance

  • 1,3′-Bipyridinium, 5′,5′′′-[1,2-ethanediylbis(4,1-phenylene-2,1-diazenediyl)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-, 2-hydroxypropanate (1:2)
  • 1,3′-Bipyridinium, 5′,5′′′-[1,2-ethanediylbis(4,1-phenyleneazo)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-, salt with 2-hydroxypropanoic acid (1:2)
  • Propanoic acid, 2-hydroxy-, ion(1-), 5′,5′′′-[1,2-ethanediylbis(4,1-phenyleneazo)]bis[1′,2′-dihydro-6′-hydroxy-4′-methyl-2′-oxo-1,3′-bipyridinium] (2:1)

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