Chem
J-GLOBAL ID：200907042613790327   Nikkaji number：J283.139B

Mikacion Yellow 4RS

ミカシオンイエロー4RS
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： C19H12Cl2N8O9S2
Molecular formula furigana： C19-H12-CL2-N8-O9-S2
Molecular weight： 631.370
InChI： InChI=1S/C19H12Cl2N8O9S2/c20-17-23-18(21)25-19(24-17)22-8-1-6-11(12(7-8)40(36,37)38)26-27-13-14(16(31)32)28-29(15(13)30)9-2-4-10(5-3-9)39(33,34)35/h1-7,13H,(H,31,32)(H,33,34,35)(H,36,37,38)(H,22,23,24,25)
InChI key： IHRFTCGTRALYFG-UHFFFAOYSA-N
SMILES： OC(=O)C1=NN(C(=O)C1N=Nc1ccc(Nc2nc(Cl)nc(Cl)n2)cc1S(=O)(=O)O)c1ccc(cc1)S(=O)(=O)O
Systematic name  (3)：
  • 4-[[4-[(4,6-ジクロロ-1,3,5-トリアジン-2-イル)アミノ]-2-スルホフェニル]アゾ]-4,5-ジヒドロ-5-オキソ-1-(4-スルホフェニル)-1H-ピラゾール-3-カルボン酸
  • 4-(2-{4-[(4,6-ジクロロ-1,3,5-トリアジン-2-イル)アミノ]-2-スルホフェニル}ジアゼン-1-イル)-5-オキソ-1-(4-スルホフェニル)-4,5-ジヒドロ-1H-ピラゾール-3-カルボン酸
  • 4-(2-{4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl}diazen-1-yl)-5-oxo-1-(4-sulfophenyl)-4,5-dihydro-1H-pyrazole-3-carboxylic acid
Other name (5)：
  • 4-[[4-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-1H-pyrazole-3-carboxylic acid
  • ミカシオンイエロー4RS
  • C.I.リアクティブオレンジ14
  • Mikacion Yellow 4RS
  • C.I.Reactive Orange 14
CAS registry number： 12225-86-4
Regulation number (2)：
  • EINECS2354320
  • (5)-2805
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