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| IUPAC Name: | 1,2,3-trichloro-5-nitrobenzene |
| Description: | 1,2,3-Trichloro-5-nitrobenzene (CAS# 20098-48-0) is used in the synthesis of thyroid hormone receptor β selective ligands that are used in hormone treatments. |
| Molecular Weight: | 226.44 |
| Molecular Formula: | C6H2Cl3NO2 |
| Canonical SMILES: | C1=C(C=C(C(=C1Cl)Cl)Cl)[N+](=O)[O-] |
| InChI: | InChI=1S/C6H2Cl3NO2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H |
| InChI Key: | HHLCSFGOTLUREE-UHFFFAOYSA-N |
| Boiling Point: | 284.1 ℃ at 760 mmHg |
| Melting Point: | 68-71 ℃ |
| Purity: | 95 % |
| Density: | 1.651 g/cm3 |
| Solubility: | less than 1 mg/mL at 59 °F |
| Appearance: | Pale-yellow crystals or yellow crystalline solid. |
| Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| MDL: | MFCD00061096 |
| LogP: | 4.07820 |
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Nitrogen Compounds
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
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