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Nitro Blue Tetrazolium Chloride monohydrate	Predict NMR spectrum	RN:  298-83-9 MF:  C40H30Cl2N10O6.H2O.CH4O MW:  867.70504 mp (°C):  170
InChI:  1S/C40H30N10O6.CH4O.2ClH.H2O/c1-55-37-25-29(13-23-35(37)47-41-39(27-9-5-3-6-10-27)45(43-47)31-15-19-33(20-16-31)49(51)52)30-14-24-36(38(26-30)56-2)48-42-40(28-11-7-4-8-12-28)46(44-48)32-17-21-34(22-18-32)50(53)54;1-2;;;/h3-26H,1-2H3;2H,1H3;2*1H;1H2/q+2;;;;/p-2 InChIKey:  RAMYNPGXWWDCAB-UHFFFAOYSA-L	H donor:  2 H acceptor:  18 Rotatable bond:  11 Stereocenter:  0	cLogP:  9.538 cLogS:  -11.118 Polar surface:  208.74
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