5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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![5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a86e4ff8569d4a00b3071198c822b1c6.png "5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid")
5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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CAS No:
63217-28-7
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Formula:
C49H54N4O12S2
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Chemical Name:
5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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Synonyms:
2,7-Naphthalenedisulfonic acid,5-(acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-;2,7-Naphthalenedisulfonic acid,5-(acetylamino)-3-[[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]azo]-4-hydroxy-;5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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CAS No:
5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid Basic Attributes
955.10266
955.10
264-024-5
Computed Properties
Molecular Weight:955.1
XLogP3:10.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:18
Exact Mass:954.31796552
Monoisotopic Mass:954.31796552
Topological Polar Surface Area:267
Heavy Atom Count:67
Complexity:1900
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-(Acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid
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