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| IUPAC Name: | 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-3-nitrobenzoic acid |
| Description: | 4-(Boc-piperazin-1-yl)-3-nitrobenzoic acid (CAS# 870703-72-3 ) is a useful research chemical. |
| Molecular Weight: | 351.35 |
| Molecular Formula: | C16H21N3O6 |
| Canonical SMILES: | CC(C)(C)OC(=O)C1CNCCN1C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-] |
| InChI: | InChI=1S/C16H21N3O6/c1-16(2,3)25-15(22)13-9-17-6-7-18(13)11-5-4-10(14(20)21)8-12(11)19(23)24/h4-5,8,13,17H,6-7,9H2,1-3H3,(H,20,21) |
| InChI Key: | JWOGAFLLVAZSCJ-UHFFFAOYSA-N |
| Boiling Point: | 529.2 °C at 760 mmHg |
| Density: | 1.329 g/cm3 |
| MDL: | MFCD07369744 |
| LogP: | 2.87620 |
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