3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid
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![3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/bd943ca927e3459fa14c12ce9bc0a21a.png "3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid")
3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
31368-39-5
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Formula:
C21H26Cl2FN5O5S2
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Chemical Name:
3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
31368-39-5;NSC130226;DTXSID00299417;NSC-130226;Ethanesulfonic acid--3-chloro-4-{2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]ethyl}benzene-1-sulfonyl fluoride (1/1)
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CAS No:
3-chloro-4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]ethyl]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
582.5 g/mol
581.0736448 g/mol
130226
DTXSID00299417
Computed Properties
Molecular Weight:582.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:581.0736448
Monoisotopic Mass:581.0736448
Topological Polar Surface Area:185
Heavy Atom Count:36
Complexity:907
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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