ChemSpider 2D Image | Dimethyl 7,7'-[(4-methyl-1,3-phenylene)bis(carbamoylimino)]diheptanoate | C25H40N4O6

Dimethyl 7,7'-[(4-methyl-1,3-phenylene)bis(carbamoylimino)]diheptanoate

  • Molecular FormulaC25H40N4O6
  • Average mass492.608 Da
  • Monoisotopic mass492.294800 Da
  • ChemSpider ID30070917

More details:

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

7,7'-[(4-Méthyl-1,3-phénylène)bis(carbamoylimino)]diheptanoate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 7,7'-[(4-methyl-1,3-phenylene)bis(carbamoylimino)]diheptanoate [ACD/IUPAC Name]
Dimethyl-7,7'-[(4-methyl-1,3-phenylen)bis(carbamoylimino)]diheptanoat [German] [ACD/IUPAC Name]
Heptanoic acid, 7,7'-[(4-methyl-1,3-phenylene)bis(iminocarbonylimino)]bis-, dimethyl ester [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: 581.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.5±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 135.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 450.67
ACD/KOC (pH 5.5): 2762.07
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 450.67
ACD/KOC (pH 7.4): 2762.04
Polar Surface Area: 135 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 427.6±3.0 cm3

Click to predict properties on the Chemicalize site


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