ChemSpider 2D Image | 1,1'-(4-Methyl-1,3-phenylene)bis{3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]urea} | C21H32N4O6

1,1'-(4-Methyl-1,3-phenylene)bis{3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]urea}

  • Molecular FormulaC21H32N4O6
  • Average mass436.502 Da
  • Monoisotopic mass436.232178 Da
  • ChemSpider ID30382640

More details:

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

1,1'-(4-Methyl-1,3-phenylen)bis{3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]harnstoff} [German] [ACD/IUPAC Name]
1,1'-(4-Methyl-1,3-phenylene)bis{3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]urea} [ACD/IUPAC Name]
1,1'-(4-Méthyl-1,3-phénylène)bis{3-[(2,2-diméthyl-1,3-dioxolan-4-yl)méthyl]urée} [French] [ACD/IUPAC Name]
Urea, N,N''-(4-methyl-1,3-phenylene)bis[N'-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 532.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 276.1±30.1 °C
Index of Refraction: 1.555
Molar Refractivity: 115.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.40
ACD/KOC (pH 5.5): 301.35
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 20.40
ACD/KOC (pH 7.4): 301.33
Polar Surface Area: 119 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 360.0±3.0 cm3

Click to predict properties on the Chemicalize site


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