8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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![8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9eeb2d29c7264c1d8762959c1cfb8e1d.png "8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid")
8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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CAS No:
104869-38-7
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Formula:
C37H30N4O21S6
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Chemical Name:
8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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Synonyms:
104869-38-7;NF 170;ACMC-20m7ov;DTXSID90332327;NF 103;1,3,5-Naphthalenetrisulfonicacid, 8,8'-[carbonylbis[imino(3-methyl-4,1-phenylene)carbonylimino]]bis-,hexasodium salt (9CI);1,3,5-Naphthalenetrisulfonic acid, 8,8'-[carbonylbis[imino(3-methyl-4,1-phenylene)carbonylimino]]bis-;8,8'-{Carbonylbis[azanediyl(3-methyl-4,1-phenylene)carbonylazanediyl]}di(naphthalene-1,3,5-trisulfonic acid);8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfo-1-naphthyl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid
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CAS No:
8-[[3-methyl-4-[[2-methyl-4-[(4,6,8-trisulfonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonic acid Basic Attributes
1059.1 g/mol
1057.9726810 g/mol
DTXSID90332327
Computed Properties
Molecular Weight:1059.1
XLogP3:-0.1
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:12
Exact Mass:1057.9726810
Monoisotopic Mass:1057.9726810
Topological Polar Surface Area:476
Heavy Atom Count:68
Complexity:2420
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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