5-O-ethyl 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate


Chemical Name: 5-O-ethyl 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number: 39562-70-4
Product Number: AG003T4X(AGN-PC-0JK6WP)
Synonyms:
MDL No: MFCD00082255
Molecular Formula: C18H20N2O6
Molecular Weight: 360.3612

Identification/Properties


Properties
MP:
1580C
BP:
464.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5700 (estimate)
Solubility:
methanol: 15 mg/mL
Computed Properties
Molecular Weight:
360.366g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
6
Exact Mass:
360.132g/mol
Monoisotopic Mass:
360.132g/mol
Topological Polar Surface Area:
110A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
661
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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