4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid
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![4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/01b912142f0f41f6a6fd6f2a2f242c9a.png "4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid")
4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
20110-95-6
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Formula:
C22H29ClFN5O7S2
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Chemical Name:
4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
20110-95-6;NSC120921;DTXSID20298129;NSC-120921;Benzenesulfonyl fluoride,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]propoxy]-, monoethanesulfonate;Benzenesulfonyl fluoride,6-diamino-2,2-dimethyl-s-triazin-1(2H)-yl)phenoxy]propoxy]-, monoethanesulfonate;Ethanesulfonic acid,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]propoxy]benzenesulfonyl fluoride (1:1);Ethanesulfonic acid--4-{3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]propoxy}benzene-1-sulfonyl fluoride (1/1)
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CAS No:
4-[3-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]propoxy]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
594.1 g/mol
593.1180965 g/mol
120921
DTXSID20298129
Computed Properties
Molecular Weight:594.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:593.1180965
Monoisotopic Mass:593.1180965
Topological Polar Surface Area:204
Heavy Atom Count:38
Complexity:917
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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