ChemSpider 2D Image | MFCD03088779 | C32H36N4O6

MFCD03088779

  • Molecular FormulaC32H36N4O6
  • Average mass572.651 Da
  • Monoisotopic mass572.263489 Da
  • ChemSpider ID3798984

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,6-Diméthyl-4-[3-(4-nitrophényl)-1-phényl-1H-pyrazol-4-yl]-1,4-dihydro-3,5-pyridinedicarboxylate de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
Bis(2-methyl-2-propanyl) 2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]
DI(TERT-BUTYL) 2,6-DIMETHYL-4-[3-(4-NITROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE
MFCD03088779
3,5-di-tert-butyl 2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate
di-tert-butyl 2,6-dimethyl-4-(3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate
di-tert-butyl 2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydropyridine-3,5-dicarboxylate
tert-butyl 5-[(tert-butyl)oxycarbonyl]-2,6-dimethyl-4-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-1,4-dihydropyridine-3-carboxylate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 681.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 366.2±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 159.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 7.36
ACD/LogD (pH 5.5): 6.84
ACD/BCF (pH 5.5): 93124.97
ACD/KOC (pH 5.5): 125393.55
ACD/LogD (pH 7.4): 6.84
ACD/BCF (pH 7.4): 93245.39
ACD/KOC (pH 7.4): 125555.70
Polar Surface Area: 128 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 469.6±7.0 cm3

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