ChemSpider 2D Image | Methyl 6-[(5-phenyl-1H-pyrazol-3-yl)oxy]hexyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate | C31H34N4O7

Methyl 6-[(5-phenyl-1H-pyrazol-3-yl)oxy]hexyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate

  • Molecular FormulaC31H34N4O7
  • Average mass574.624 Da
  • Monoisotopic mass574.242737 Da
  • ChemSpider ID119119

More details:






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

2,6-Diméthyl-4-(3-nitrophényl)-1,4-dihydro-3,5-pyridinedicarboxylate de méthyle et de 6-[(5-phényl-1H-pyrazol-3-yl)oxy]hexyle [French] [ACD/IUPAC Name]
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, methyl 6-[(5-phenyl-1H-pyrazol-3-yl)oxy]hexyl ester [ACD/Index Name]
Methyl 6-[(5-phenyl-1H-pyrazol-3-yl)oxy]hexyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
Methyl-6-[(5-phenyl-1H-pyrazol-3-yl)oxy]hexyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]
1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid methyl-6-(5-phenyl-3-pyrazolyloxy)hexyl ester
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, methyl 6-((5-phenyl-1H-pyrazol-3-yl)oxy)hexyl ester
3-Methyl 5-(6-((5-phenyl-1H-pyrazol-3-yl)oxy)hexyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
86384-98-7 [RN]
CV-159-6

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

CV 159 [DBID]
CV-159 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 755.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 410.7±32.9 °C
Index of Refraction: 1.586
Molar Refractivity: 154.4±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 6.63
ACD/LogD (pH 5.5): 6.03
ACD/BCF (pH 5.5): 22584.12
ACD/KOC (pH 5.5): 45466.75
ACD/LogD (pH 7.4): 6.03
ACD/BCF (pH 7.4): 22646.10
ACD/KOC (pH 7.4): 45591.52
Polar Surface Area: 148 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 460.0±3.0 cm3

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