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4-Ethynylaniline	Predict NMR spectrum	RN:  14235-81-5 MF:  C8H7N MW:  117.15028
InChI:  1S/C8H7N/c1-2-7-3-5-8(9)6-4-7/h1,3-6H,9H2 InChIKey:  JXYITCJMBRETQX-UHFFFAOYSA-N	H donor:  1 H acceptor:  1 Rotatable bond:  0 Stereocenter:  0	cLogP:  1.567 cLogS:  -1.125 Polar surface:  26.02 NEW: 3D model:  Show
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