5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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![5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ea5bd16aa10d4653813bc3ea33b68f4c.png "5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid")
5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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CAS No:
68252-85-7
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Formula:
C29H21Br2N5O13S3
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Chemical Name:
5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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Synonyms:
2,7-Naphthalenedisulfonic acid,5-[[4-[(2-bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-;2,7-Naphthalenedisulfonic acid,5-[[4-[(2-bromo-1-oxo-2-propenyl)amino]benzoyl]amino]-3-[[5-[(2-bromo-1-oxo-2-propenyl)amino]-2-sulfophenyl]azo]-4-hydroxy-;5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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CAS No:
5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid Basic Attributes
903.50574
903.51
269-485-6
Computed Properties
Molecular Weight:903.5
XLogP3:3.6
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:11
Exact Mass:902.86443
Monoisotopic Mass:900.86647
Topological Polar Surface Area:321
Heavy Atom Count:52
Complexity:1770
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-[[4-[(2-Bromo-1-oxo-2-propen-1-yl)amino]benzoyl]amino]-3-[2-[5-[(2-bromo-1-oxo-2-propen-1-yl)amino]-2-sulfophenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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