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CAS 41078-70-0: 3-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Formula:C11H11ClN2O
InChI:InChI=1S/C11H11ClN2O/c1-8-9(5-6-12)11(15)14-7-3-2-4-10(14)13-8/h2-4,7H,5-6H2,1H3
InChI key:InChIKey=LFTGLYCNMGGMKL-UHFFFAOYSA-N
SMILES:O=C1N2C(=NC(C)=C1CCCl)C=CC=C2
Synonyms:- 3-(2-Chloroethyl)-2-Methylpyrido[1,2-A]Pyrimidin-4-One
- 4H-Pyrido[1,2-a]pyrimidin-4-one, 3-(2-chloroethyl)-2-methyl-
- 3-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
- :3-(2-chloroethyl)-2-methyl-4h-pyrido-[1,2-a]pyrimidin-4-one
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3-(2-Chloroethyl)-2-Methyl-4H-Pyrido[1,2-a]Pyrimidin-4-One
CAS:3-(2-Chloroethyl)-2-Methyl-4H-Pyrido[1,2-a]Pyrimidin-4-OnePurity:98%Molecular weight:222.67g/mol3-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CAS:Applications An intermediate in the synthesis of Risperidone (R525000), which is a combined serotonin (5-HT2) and dopamine (D2) receptor antagonist. Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package References Brown, T., et al.: J. Med. Chem., 33, 527 (1990), Yapi, A., et al.: Chem. Pharm. Bull., 48, 1886 (2000), Yapi, A., et al.: Arch. Pharm., 339, 201 (2006); Jannssen, P.A.J., et al.: J. Pharmacol. Exp. Ther., 244, 685 (1988); Gelders, Y.G., et al.: Pharmacopsychiatry, 23, 206 (1990); Green, B.: Curr. Med. Res. Opin., 16, 57 (2000);Formula:C11H11ClN2OColor and Shape:NeatMolecular weight:222.673-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CAS:3-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one is a chemical compound that is used to synthesize the drug paliperidone. The reaction time of this synthesis reaction is high and the yield is high. The conformation of the product can be predicted with theory. The hydrochloride salt of the product has a higher solubility in water than does the free base form. The reactants are 3-(2-chloroethyl) pyridine and 2-methyl 4H pyrido[1,2-a]pyrimidin-4-one, which are both cheap and easily accessible. This synthesis can be carried out using solvents such as phosphorus oxychloride or carbonyl oxychloride. The dihedral angle for this molecule is around 100 degrees, which makes it a planar molecule. This compound reacts with pyridineFormula:C11H11ClN2OPurity:Min. 95%Molecular weight:222.67 g/mol3-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CAS:Formula:C11H11ClN2OPurity:98%Color and Shape:SolidMolecular weight:222.67084000000003Risperidone Impurity 3
CAS:Formula:C11H11ClN2OColor and Shape:White To Off-White SolidMolecular weight:222.673-(2-Chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CAS:Formula:C11H11ClN2OPurity:>98.0%(GC)(T)Color and Shape:White to Light yellow powder to crystalMolecular weight:222.673-(2-Chloro-ethyl)-2-methyl-pyrido[1,2-a]pyrimidin-4-one
CAS:Purity:97.0%Color and Shape:SolidMolecular weight:222.6699981689453