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2-methyl-4-nitrobenzoic acid 2-methyl-4-nitro-benzoic acid	Predict NMR spectrum	RN:  1975-51-5 MF:  C8H7NO4 MW:  181.14788
InChI:  1S/C8H7NO4/c1-5-4-6(9(12)13)2-3-7(5)8(10)11/h2-4H,1H3,(H,10,11) InChIKey:  XXXOBNJIIZQSPT-UHFFFAOYSA-N	H donor:  1 H acceptor:  5 Rotatable bond:  2 Stereocenter:  0	cLogP:  1.686 cLogS:  -2.433 Polar surface:  83.12 NEW: 3D model:  Show
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