Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)
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![Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c5673640b4b84b80ab6b4d50a60139d4.png "Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)")
Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)
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CAS No:
5844-02-0
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Formula:
C35H33N3O6S2.Na
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Chemical Name:
Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)
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Synonyms:
Methanaminium,N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-,inner salt,sodium salt (1:1);C.I. Acid Blue 17;Methanaminium,N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-,inner salt,sodium salt;C.I. 42625;Acilan Violet 7BN
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CAS No:
Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1) Basic Attributes
678.77279
678.171
611-653-1
Computed Properties
Molecular Weight:678.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:678.17084741
Monoisotopic Mass:678.17084741
Topological Polar Surface Area:138
Heavy Atom Count:47
Formal Charge:1
Complexity:1390
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Methanaminium, N-[4-[bis[4-[methyl(3-sulfophenyl)amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)
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