Disodium 2-[4-[[1-[[(2-methoxy-5-methyl-4-sulphonatophenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-6-methylbenzothiazole-7-sulphonate

Base Information

• Chemical Name: Disodium 2-[4-[[1-[[(2-methoxy-5-methyl-4-sulphonatophenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-6-methylbenzothiazole-7-sulphonate
• CAS No.: 72705-26-1
• Molecular Formula: C26H22N4Na2O9S3
• Molecular Weight: 676.65
• European Community (EC) Number: 276-771-4
• DSSTox Substance ID: DTXSID501335821
• Nikkaji Number: J296.346I
• Mol file: 72705-26-1.mol

Synonyms:72705-26-1;EINECS 276-771-4;disodium 2-[4-[[1-[[(2-methoxy-5-methyl-4-sulphonatophenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-6-methylbenzothiazole-7-sulphonate;disodium;2-[4-[[1-(2-methoxy-5-methyl-4-sulfonatoanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]-6-methyl-1,3-benzothiazole-7-sulfonate;Disodium 2-(4-((1-(((2-methoxy-5-methyl-4-sulphonatophenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)-6-methylbenzothiazole-7-sulphonate;Direct Yellow 157;SCHEMBL2795964;C26H24N4O9S3.2Na;DTXSID501335821;C26-H24-N4-O9-S3.2Na;FT-0721600;2-[4-[1-[2-Methoxy-5-methyl-4-(sodiosulfo)phenylaminocarbonyl]-2-oxopropylazo]phenyl]-6-methyl-7-benzothiazolesulfonic acid sodium salt;7-Benzothiazolesulfonic acid, 2-(4-((1-(((2-methoxy-5-methyl-4-sulfophenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)-6-methyl-, disodium salt;7-Benzothiazolesulfonic acid, 2-[4-[[1-[[(2-methoxy-5-methyl- 4-sulfophenyl)amino]carbonyl]-2-oxopropyl]azo ]phenyl]-6-methyl-, disodium salt;7-Benzothiazolesulfonic acid, 2-[4-[2-[1-[[(2-methoxy-5-methyl-4-sulfophenyl)amino]carbonyl]-2-oxopropyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2);disodium 2-{4-[(1E)-2-{1-[(2-methoxy-5-methyl-4-sulfonatophenyl)carbamoyl]-2-oxopropyl}diazen-1-yl]phenyl}-6-methyl-1,3-benzothiazole-7-sulfonate;sodium (E)-2-(4-((1-((2-methoxy-5-methyl-4-sulfonatophenyl)amino)-1,3-dioxobutan-2-yl)diazenyl)phenyl)-6-methylbenzo[d]thiazole-7-sulfonate;Sodium 2-(4-((1-((2-methoxy-5-methyl-4-sulfonatophenyl)amino)-1,3-dioxobutan-2-yl)diazenyl)phenyl)-6-methylbenzo[d]thiazole-7-sulfonate;Sodium2-(4-((1-((2-methoxy-5-methyl-4-sulfonatophenyl)amino)-1,3-dioxobutan-2-yl)diazenyl)phenyl)-6-methylbenzo[d]thiazole-7-sulfonate

Chemical Property of Disodium 2-[4-[[1-[[(2-methoxy-5-methyl-4-sulphonatophenyl)amino]carbonyl]-2-oxopropyl]azo]phenyl]-6-methylbenzothiazole-7-sulphonate

Chemical Property:

• Vapor Pressure: 0Pa at 25℃
• PSA: 252.41000
• Density: 1.608[at 20℃]
• LogP: 6.31150
• Water Solubility.: 82.04g/L at 20℃
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 7
• Exact Mass: 676.03443038
• Heavy Atom Count: 44
• Complexity: 1200

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C(=C4)C)S(=O)(=O)[O-])OC)S(=O)(=O)[O-].[Na+].[Na+]