Reactive Yellow 86 - ≥95% , CAS No.61951-86-8

CAS: 61951-86-8 Cat. No.: R331861 Peso molecular: 667.37

GRADE & PURITY ≥95%

Synonyms

CID 101531203 | DTXSID80894186 | disodium;5-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2,4-disulfophenyl]diazenyl]-1-ethyl-4-methyl-2-oxido-6-oxopyridine-3-carboximidate

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

CID 101531203 | DTXSID80894186 | disodium;5-[[5-[(4, 6-dichloro-1, 3, 5-triazin-2-yl)amino]-2, 4-disulfophenyl]diazenyl]-1-ethyl-4-methyl-2-oxido-6-oxopyridine-3-carboximidate

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CCN1C(=C(C(=C(C1=O)N=NC2=C(C=C(C(=C2)NC3=NC(=NC(=N3)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O)C)C(=N)[O-])[O-].[Na+].[Na+]
• IUPAC Name: disodium;5-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2,4-disulfophenyl]diazenyl]-1-ethyl-4-methyl-2-oxido-6-oxopyridine-3-carboximidate
• InChIKey: WOFHPDGARHNFJI-UHFFFAOYSA-L
• INCHI: 1S/C18H16Cl2N8O9S2.2Na/c1-3-28-14(30)11(13(21)29)6(2)12(15(28)31)27-26-8-4-7(22-18-24-16(19)23-17(20)25-18)9(38(32,33)34)5-10(8)39(35,36)37;;/h4-5,30H,3H2,1-2H3,(H2,21,29)(H,32,33,34)(H,35,36,37)(H,22,23,24,25);;/q;2*+1/p-2
• Isómeros SMILES: CCN1C(=C(C(=C(C1=O)N=NC2=C(C=C(C(=C2)NC3=NC(=NC(=N3)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O)C)C(=N)[O-])[O-].[Na+].[Na+]
• CAS alternativo: 70865-29-1
• Peso molecular: 667.37

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzenesulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzenesulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonic acids and derivatives
• Alternative Parents: 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Nicotinamides Aniline and substituted anilines Pyridinones Pyridinolates Aminotriazines Chloro-s-triazines Dihydropyridines Methylpyridines Aryl chlorides Sulfonyls Organosulfonic acids Heteroaromatic compounds Azo compounds Lactams Organic metal halides Carboximidic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organic sodium salts Organochlorides Organooxygen compounds Amines Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Nicotinamide - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Aniline or substituted anilines - Pyridinolate - Amino-1,3,5-triazine - Pyridinone - Chloro-s-triazine - Halo-s-triazine - Dihydropyridine - Methylpyridine - Aminotriazine - Hydropyridine - Pyridine - Triazine - 1,3,5-triazine - Aryl chloride - Aryl halide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - Lactam - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic metal halide - Organoheterocyclic compound - Carboximidic acid - Carboximidic acid derivative - Azacycle - Organic alkali metal salt - Organic oxygen compound - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Amine - Organooxygen compound - Organosulfur compound - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Referencias

1. Najmeh Zare, Tao Wu, Dongxing Zhang, Nianbing Zhong, Li Fu, Tejraj M. Aminabhavi, Hassan Karimi-Maleh.  (2025)  Efficient removal of Congo red using adsorbents prepared via MOF-on-MOF strategy.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.171592]