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3-Acetylbenzonitrile	Predict NMR spectrum	RN:  6136-68-1 MF:  C9H7NO MW:  145.16068 bp (°C):  120  (p=5 torr) mp (°C):  96  - 100
InChI:  1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3 InChIKey:  SBCFGFDAZCTSRH-UHFFFAOYSA-N	H donor:  0 H acceptor:  2 Rotatable bond:  1 Stereocenter:  0	cLogP:  1.715 cLogS:  -3.073 Polar surface:  40.86 NEW: 3D model:  Show
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