diethyl 2,6-dimethyl-4-(2,3,4,5,6-pentafluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate


Chemical Name: diethyl 2,6-dimethyl-4-(2,3,4,5,6-pentafluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number: 54280-71-6
Product Number: AG00DM1V(AGN-PC-0KM5HB)
Synonyms:
MDL No: MFCD00335178
Molecular Formula: C19H18F5NO4
Molecular Weight: 419.3425

Identification/Properties


Computed Properties
Molecular Weight:
419.348g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
7
Exact Mass:
419.116g/mol
Monoisotopic Mass:
419.116g/mol
Topological Polar Surface Area:
64.6A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
669
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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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