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4-NITRO-2-(2,5,5-TRIMETHYL-[1,3]DIOXAN-2-YL)-BENZOIC ACID

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Name: 4-NITRO-2-(2,5,5-TRIMETHYL-[1,3]DIOXAN-2-YL)-BENZOIC ACID
CAS: 217197-04-1
Synonyms: 4-NITRO-2-(2,5,5-TRIMETHYL-[1,3]DIOXAN-2-YL)-BENZOIC ACID
MDL.: MFCD09878459
H bond acceptor: 7
H bond donor: 1
Smile: CC1(COC(OC1)(C)c2cc(ccc2C(=O)O)[N+](=O)[O-])C
InChi: InChI=1S/C14H17NO6/c1-13(2)7-20-14(3,21-8-13)11-6-9(15(18)19)4-5-10(11)12(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)
InChiKey: InChIKey=GBUSGOLTSBLLGX-UHFFFAOYSA-N

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