Name | 3-oxo-3-[4-(trifluoromethyl)phenyl]propanenitrile |
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Synonyms |
Benzenepropanenitrile, β-oxo-4-(trifluoromethyl)-
β-Oxo-4-(trifluoromethyl)benzenepropanenitrile 3-oxo-3-<4-trifluoromethylphenyl>propanenitrile 3-Oxo-3-[4-(trifluoromethyl)phenyl]propanenitrile 3-Oxo-3-[4-(trifluoromethyl)phenyl]propionitrile 4-trifluoromethylbenzoylacetonitrile NC1VR DXFFF 4-(Trifluoromethyl)benzoylacetonitrile |
Density | 1.3±0.1 g/cm3 |
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Boiling Point | 316.2±42.0 °C at 760 mmHg |
Melting Point | 43-45ºC |
Molecular Formula | C10H6F3NO |
Molecular Weight | 213.156 |
Flash Point | 145.0±27.9 °C |
Exact Mass | 213.040146 |
PSA | 40.86000 |
LogP | 1.94 |
Vapour Pressure | 0.0±0.7 mmHg at 25°C |
Index of Refraction | 1.469 |
Hazard Codes | T: Toxic; |
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HS Code | 2926909090 |
~15% 71682-94-5 |
Literature: SMITHKLINE BEECHAM CORPORATION Patent: WO2004/785 A2, 2003 ; Location in patent: Page 25 ; WO 2004/000785 A2 |
~78% 71682-94-5 |
Literature: Barhdadi, Rachid; Gal, Jacques; Heintz, Monique; Troupel, Michel Journal of the Chemical Society, Chemical Communications, 1992 , # 1 p. 50 - 51 |
~% 71682-94-5 |
Literature: Journal of Medicinal Chemistry, , vol. 22, # 11 p. 1385 - 1389 |
~% 71682-94-5 |
Literature: Journal of Medicinal Chemistry, , vol. 22, # 11 p. 1385 - 1389 |
~% 71682-94-5 |
Literature: Synthesis, , # 3 p. 337 - 341 |
~% 71682-94-5 |
Literature: Synthesis, , # 3 p. 337 - 341 |
~% 71682-94-5 |
Literature: Journal of Medicinal Chemistry, , vol. 34, # 11 p. 3295 - 3301 |
Precursor 6 | |
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DownStream 1 | |
HS Code | 2926909090 |
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Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |