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Reference substances

Reference substances

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General information

Inventory

EC number:
226-107-4
EC name:
3,3'-[(2,5-dimethyl-p-phenylene)bis[imino(1-acetyl-2-oxoethylene)azo]]bis[4-chloro-N-(5-chloro-o-tolyl)benzamide]
CAS number:
5280-80-8

No inventory information available

Reference substance information

IUPAC name:
3,3'-{(2,5-dimethyl-1,4-phenylene)bis[imino(1,3-dioxobutane-2,1-diyl)diazene-2,1-diyl]}bis[4-chloro-N-(5-chloro-2-methylphenyl)benzamide]
Synonyms
Names:
Benzamide, 3,3'-((2,5-dimethyl-1,4-phenylene)bis(imino(1-acetyl-2-oxo-2,1-ethanediyl)azo))bis(4-chloro-N-(5-chloro-2-methylphenyl)-
Benzamide, 3,3'-[(2,5-dimethyl-1,4-phenylene) bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo ]]bis[4-chloro-N-(5-chloro-2-methylphenyl)-
Benzamide, 3,3'-[(2,5-dimethyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis[4-chloro-N-(5-chloro-2-methylphenyl)-

CAS information

CAS number:
5280-80-8

Molecular and structural information

Molecular formula:
C44H38Cl4N8O6
Molecular weight:
916.635
SMILES notation:
Cc1c(cc(cc1)Cl)NC(=O)c2cc(c(cc2)Cl)/N=N/C(C(=O)Nc3c(cc(c(c3)C)NC(=O)C(/N=N/c4c(ccc(c4)C(=O)Nc5c(ccc(c5)Cl)C)Cl)C(=O)C)C)C(=O)C
InChl:
InChI=1S/C44H38Cl4N8O6/c1-21-7-11-29(45)19-35(21)49-41(59)27-9-13-31(47)37(17-27)53-55-39(25(5)57)43(61)51-33-15-24(4)34(16-23(33)3)52-44(62)40(26(6)58)56-54-38-18-28(10-14-32(38)48)42(60)50-36-20-30(46)12-8-22(36)2/h7-20,39-40H,1-6H3,(H,49,59)(H,50,60)(H,51,61)(H,52,62)/b55-53+,56-54+
Structural formula:
Chemical structure