Chem
J-GLOBAL ID：200907088735208807   Nikkaji number：J225.023C

PY-83

C.I.ピグメントイエロー83
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C36H32Cl4N6O8
Molecular formula furigana： C36-H32-CL4-N6-O8
Molecular weight： 818.490
InChI： InChI=1S/C36H32Cl4N6O8/c1-17(47)33(35(49)41-27-15-29(51-3)23(39)13-31(27)53-5)45-43-25-9-7-19(11-21(25)37)20-8-10-26(22(38)12-20)44-46-34(18(2)48)36(50)42-28-16-30(52-4)24(40)14-32(28)54-6/h7-16,33-34H,1-6H3,(H,41,49)(H,42,50)
InChI key： NKXPXRNUMARIMZ-UHFFFAOYSA-N
SMILES： COc1cc(NC(=O)C(N=Nc2ccc(cc2Cl)c2ccc(N=NC(C(=O)C)C(=O)Nc3cc(OC)c(Cl)cc3OC)c(Cl)c2)C(=O)C)c(OC)cc1Cl
Systematic name  (3)：
  • 2,2′-[(3,3′-ジクロロ-1,1′-ビフェニル-4,4′-ジイル)ビス(アゾ)]ビス[N-(4-クロロ-2,5-ジメトキシフェニル)-3-オキソブタンアミド]
  • N-(4-クロロ-2,5-ジメトキシフェニル)-2-{2-[3,3'-ジクロロ-4'-(2-{1-[(4-クロロ-2,5-ジメトキシフェニル)カルバモイル]-2-オキソプロピル}ジアゼン-1-イル)-[1,1'-ビフェニル]-4-イル]ジアゼン-1-イル}-3-オキソブタンアミド
  • N-(4-chloro-2,5-dimethoxyphenyl)-2-{2-[3,3'-dichloro-4'-(2-{1-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-2-oxopropyl}diazen-1-yl)-[1,1'-biphenyl]-4-yl]diazen-1-yl}-3-oxobutanamide
Other name (4)：
  • 2,2′-[(3,3′-Dichloro-1,1′-biphenyl-4,4′-diyl)bis(azo)]bis[N-(4-chloro-2,5-dimethoxyphenyl)-3-oxobutanamide]
  • PY-83
  • C.I.ピグメントイエロー83
  • C.I.Pigment Yellow 83
CAS registry number： 5567-15-7
Regulation number (2)：
  • EINECS2269398
  • TSCA(5567-15-7)
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