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sec-Butyl isothiocyanate	Predict NMR spectrum	RN:  4426-79-3 MF:  C5H9NS MW:  115.19316 bp (°C):  58  - 60  (p=15 torr) density:  0.93
InChI:  1S/C5H9NS/c1-3-5(2)6-4-7/h5H,3H2,1-2H3 InChIKey:  TUFJIDJGIQOYFY-UHFFFAOYSA-N	H donor:  0 H acceptor:  1 Rotatable bond:  2 Stereocenter:  1	cLogP:  3.393 cLogS:  -2.071 Polar surface:  44.45 NEW: 3D model:  Show
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