ChemSpider 2D Image | 1,1'-{1,4-Phenylenebis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}dipropan-1-one | C34H38N4O6

1,1'-{1,4-Phenylenebis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}dipropan-1-one

  • Molecular FormulaC34H38N4O6
  • Average mass598.689 Da
  • Monoisotopic mass598.279114 Da
  • ChemSpider ID2345175

More details:






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

1,1'-{1,4-Phenylenbis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3,1-diyl]}di(1-propanon) [German] [ACD/IUPAC Name]
1,1'-{1,4-Phenylenebis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}di(1-propanone) [ACD/IUPAC Name]
1,1'-{1,4-Phénylènebis[5-(2,3-diméthoxyphényl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}di(1-propanone) [French] [ACD/IUPAC Name]
1,1'-{1,4-Phenylenebis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}dipropan-1-one
1-Propanone, 1,1'-[1,4-phenylenebis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]]bis- [ACD/Index Name]
1-(5-(2,3-Dimethoxy-phenyl)-3-{4-[5-(2,3-dimethoxy-phenyl)-1-propionyl-4,5-dihydro-1H-pyrazol-3-yl]-phenyl}-4,5-dihydro-pyrazol-1-yl)-propan-1-one
1,1'-(5S,5'S)-3,3'-(1,4-Phenylene)bis(5-(2,3-dimethoxyphenyl)-1H-pyrazole-3,1(4H,5H)-diyl)dipropan-1-one
1,1'-{benzene-1,4-diylbis[5-(2,3-dimethoxyphenyl)-4,5-dihydro-1H-pyrazole-3,1-diyl]}dipropan-1-one

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

BAS 00009677 [DBID]
ChemDiv1_002407 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 697.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.1±3.0 kJ/mol
Flash Point: 375.5±34.3 °C
Index of Refraction: 1.607
Molar Refractivity: 166.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.95
ACD/KOC (pH 5.5): 973.27
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 104.95
ACD/KOC (pH 7.4): 973.28
Polar Surface Area: 102 Å2
Polarizability: 66.1±0.5 10-24cm3
Surface Tension: 44.1±7.0 dyne/cm
Molar Volume: 482.6±7.0 cm3

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