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Name | Etoricoxib Impurity 29 |
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Synonyms | 2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone |
Molecular Structure | ![]() |
Molecular Formula | C14H13NO3S |
Molecular Weight | 275.32 |
CAS Registry Number | 40061-50-5 |
SMILES | CS(=O)(=O)C1=CC=C(C=C1)CC(=O)C2=CN=CC=C2 |
Solubility | 3803 mg/L (25 ºC water) |
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Density | 1.3±0.1 g/cm3, Calc.* |
Index of Refraction | 1.580, Calc.* |
Melting point | 165.52 ºC |
Boiling Point | 415.76 ºC, 506.3±50.0 ºC (760 mmHg), Calc.* |
Flash Point | 260.0±30.1 ºC, Calc.* |
* | Calculated using Advanced Chemistry Development (ACD/Labs) Software. |
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