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TH-PVP is a new research chemical with the IUPAC or formal name of 2-(pyrrolidin-1-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-one, chemical formula of C19H27NO, and a molecular mass of 285.42.
Research on compound was published by ACD/Labs’, US Environmental Protection Agency’s EPISuite, and ChemAxon. In the reports by ACD/Labs the chemical has 2 hydrogen acceptors, 0 hydrogen donor, 5 freely rotating bonds, an index of refraction of 1.538, with a surface tension of 40.0±3.0 dyne/cm, a flash point of 119.0±12.5 °C and a boiling point of 340.8±25.0 °C at 760 mmHg.
The research published by US Environmental Protection Agency’s EPISuite showed the boiling point to be 326.57, a melting point of 96.11, and water solubility at 25 deg C (mg/L): 139.4. Removal in wastewater treatment showed total removal at 26.14%, total biodegradation at .029%, total sludge adsorption at 25.84%, and total to air at 0.01%.
ChemAxon published a topology analysis, which revealed an atom count of 38, bond count of 39, cyclomatic number of 2, chain atom count of 6, chain bond count of 7, asymmetric atom count of 1, and rotatable bond count of 5. Under geometry, the report revealed a dreiding energy equal to 52.41 kcal/mol with a volume equal to 238.97 Å2, a minimal projection area equal to 11.49 Å and maximum projection area equal to 67.71 Å2.
TH-PVP is intended for research purposes in a controlled laboratory for scientific and forensic study only and is NOT intended for human or animal consumption.
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