(Butyryloxy)Methyl Methyl (4R)-4-(2,3-Dichlorophenyl)-2,6-Dimethyl-1,4-Dihydro-3,5-Pyridinedicarboxylate

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Properties Simple | Detailed

Formula C21H23Cl2NO6
IUPAC Name o5-(butanoyloxymethyl) o3-methyl (4r)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 456.316 g·mol−1
Heat of Formation -1115.7 ± 16.7 kJ·mol−1
Dipole Moment 5.98 ± 1.08 D
Volume 504.22 Å 3
Surface Area 377.15 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.49 ± eV
Point Group Symmetry C1
Synonyms
  • ( -)-hydroxymethyl-methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, butyrate (ester).
  • (4r)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid o3-(butyryloxymethyl) o5-methyl ester
  • (4r)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid o5-methyl o3-(1-oxobutoxymethyl) ester
  • clevidipine
  • o3-(butanoyloxymethyl) o5-methyl (4r)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number(s)
  • 166432-28-6
InChIKey KPBZROQVTHLCDU-GOSISDBHSA-N
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Elements H C N O Cl