1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione
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![1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/85de6f7a54c5478796f828bc536f0625.png "1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione")
1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione
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CAS No:
114565-66-1
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Formula:
C23H18N2O8
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Chemical Name:
1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione
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Synonyms:
9,10-Anthracenedione,1,8-dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-;1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione
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CAS No:
1,8-Dihydroxy-4-[[4-[2-hydroxy-1-(hydroxymethyl)ethyl]phenyl]amino]-5-nitro-9,10-anthracenedione Basic Attributes
450.39800
450.40
406-057-1
DTXSID30699229
Safety Information
R40; R43; R53
36/37-61
Xn
|Warning|H317: May cause an allergic skin reaction [Warning Sensitization, Skin]|P201, P202, P261, P272, P273, P280, P281, P302+P352, P308+P313, P321, P333+P313, P363, P405, and P501
Computed Properties
Molecular Weight:450.4
XLogP3:3.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:450.10631554
Monoisotopic Mass:450.10631554
Topological Polar Surface Area:173
Heavy Atom Count:33
Complexity:745
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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