REACTIVE RED 45 ,70210-46-7 _ChemCD

REACTIVE RED 45

basic_info
Product_Name：	REACTIVE RED 45
CAS：	70210-46-7 ;12226-22-1
EnglishSynonyms：	REACTIVE RED 45 ; TRISODIUM 5-[[4-CHLORO-6-(METHYLPHENYLAMINO)-1,3,5-TRIAZIN-2-YL]AMINO]-4-HYDROXY-3-[(4-METHYL-2-SULPHONATOPHENYL)AZO]NAPHTHALENE-2,7-DISULPHONATE
pro_mdlNumber：	MFCD00800434
pro_acceptors：	17
pro_donors：	3
pro_smile：	Cc1ccc(cc1)Nc2nc(nc(n2)Cl)Nc3cc(cc4c3c(c(c(c4)S(=O)(=O)[O-])/N=N/c5ccc(cc5S(=O)(=O)[O-])C)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi：	InChI=1S/C27H22ClN7O10S3.3Na/c1-13-3-6-16(7-4-13)29-26-31-25(28)32-27(33-26)30-19-12-17(46(37,38)39)10-15-11-21(48(43,44)45)23(24(36)22(15)19)35-34-18-8-5-14(2)9-20(18)47(40,41)42;;;/h3-12,36H,1-2H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H2,29,30,31,32,33);;;/q;3*+1/p-3/b35-34+;;;
InChiKey：	InChIKey=AUKLZQPZSCNORC-FEISSGSOSA-K

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