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74936-72-4

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Basic Information
CAS No.: 74936-72-4
Name: 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 3-Methyl Ester
Article Data: 24
Molecular Structure:
Molecular Structure of 74936-72-4 (1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 3-Methyl Ester)
Formula: C16H16N2O6
Molecular Weight: 332.313
Synonyms: 3,5-Pyridinedicarboxylicacid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, monomethyl ester (9CI);2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acidmonomethyl ester;2,6-Dimethyl-5-methoxycarbonyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylicacid;
EINECS: 278-034-2
Density: 1.345 g/cm3
Melting Point: 200-202oC
Boiling Point: 505 °C at 760 mmHg
Flash Point: 259.2 °C
PSA: 121.45000
LogP: 2.93920
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Chemistry

Molecular Structure of 3,5-Pyridinedicarboxylicacid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-methyl ester (CAS NO.74936-72-4):

IUPAC Name: 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid
Empirical Formula: C16H16N2O6
Molecular Weight: 332.308
H bond acceptors: 8
H bond donors: 2
Freely Rotating Bonds: 5
Polar Surface Area: 101.66 Å2
Index of Refraction: 1.587
Molar Refractivity: 83.06 cm3
Molar Volume: 246.9 cm3
Surface Tension: 52.9 dyne/cm
Density: 1.345 g/cm3
Flash Point: 259.2 °C
Enthalpy of Vaporization: 81.56 kJ/mol
Boiling Point: 505 °C at 760 mmHg
Vapour Pressure: 5.1E-11 mmHg at 25°C
EINECS: 278-034-2
InChI
InChI=1/C16H16N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-5-4-6-11(7-10)18(22)23/h4-7,14,17H,1-3H3,(H,19,20)
Smiles
C1(=C([C@@H](C(=C(N1)C)C(=O)O)c1cc(ccc1)[N+](=O)[O-])C(=O)OC)C

Specification

 3,5-Pyridinedicarboxylicacid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-methyl ester , with CAS number of 74936-72-4, can be called 2,6-Dimethyl-5-methoxy carbonyl-4-(3-nitro-phenyl)-1,4-dihydropyridine-3-carboxylic acid ; 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 3-Methyl Ester ; Lercanidipine mainring ; rac-1,4-Dihydro-5-(methoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylic Acid ; 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylic acid 3-methyl ester ; Methyl hydrogen 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate .