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Thiamine hydrochloride	Predict NMR spectrum	RN:  67-03-8 MF:  C12H17ClN4OS.HCl MW:  337.26712 mp (°C):  246  - 254
InChI:  1S/C12H17N4OS.2ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);2*1H/q+1;;/p-1 InChIKey:  DPJRMOMPQZCRJU-UHFFFAOYSA-M	H donor:  2 H acceptor:  5 Rotatable bond:  4 Stereocenter:  0	cLogP:  0.544 cLogS:  -0.76 Polar surface:  104.15
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