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| IUPAC Name: | 2-nitrobenzene-1,3,5-triol |
| Description: | 2-Nitrophloroglucinol (CAS# 16600-92-3) is a useful synthetic intermediate. It is used to prepare benzoxazoles and benzothiazoles as selective ligands for human β-estrogen receptor (ER-β). |
| Molecular Weight: | 171.11 |
| Molecular Formula: | C6H5NO5 |
| Canonical SMILES: | C1=C(C=C(C(=C1O)[N+](=O)[O-])O)O |
| InChI: | InChI=1S/C6H5NO5/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,8-10H |
| InChI Key: | QSVQZFVXAUGEMT-UHFFFAOYSA-N |
| Boiling Point: | 343 °C at 760 mmHg |
| Melting Point: | 189-193 °C (lit.) |
| Purity: | 95 % |
| Density: | 1.771 g/cm3 |
| MDL: | MFCD00016996 |
| LogP: | 1.23480 |
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Oxygen Compounds
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
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