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Esculetin	Predict NMR spectrum	RN:  305-01-1 MF:  C9H6O4 MW:  178.14424 mp (°C):  266
InChI:  1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H InChIKey:  ILEDWLMCKZNDJK-UHFFFAOYSA-N	H donor:  2 H acceptor:  4 Rotatable bond:  0 Stereocenter:  0	cLogP:  1.354 cLogS:  -1.778 Polar surface:  66.76 NEW: 3D model:  Show
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