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Propyl isothiocyanate	Predict NMR spectrum	RN:  628-30-8 MF:  C4H7NS MW:  101.16628 bp (°C):  153 density:  0.978 nd:  1.503  - 1.505
InChI:  1S/C4H7NS/c1-2-3-5-4-6/h2-3H2,1H3 InChIKey:  KKASGUHLXWAKEZ-UHFFFAOYSA-N	H donor:  0 H acceptor:  1 Rotatable bond:  2 Stereocenter:  0	cLogP:  2.99 cLogS:  -1.693 Polar surface:  44.45 NEW: 3D model:  Show
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