ChemSpider 2D Image | 2-Methyl-2-propanyl [1-{[1-(3,4-dimethylphenyl)-2-(2-naphthylamino)-2-oxoethyl](2-hydroxyethyl)amino}-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]carbamate | C36H41N3O6

2-Methyl-2-propanyl [1-{[1-(3,4-dimethylphenyl)-2-(2-naphthylamino)-2-oxoethyl](2-hydroxyethyl)amino}-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]carbamate

  • Molecular FormulaC36H41N3O6
  • Average mass611.727 Da
  • Monoisotopic mass611.299561 Da
  • ChemSpider ID16558786

More details:






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

[1-{[1-(3,4-Diméthylphényl)-2-(2-naphtylamino)-2-oxoéthyl](2-hydroxyéthyl)amino}-3-(4-hydroxyphényl)-1-oxo-2-propanyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [1-{[1-(3,4-dimethylphenyl)-2-(2-naphthylamino)-2-oxoethyl](2-hydroxyethyl)amino}-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[1-{[1-(3,4-dimethylphenyl)-2-(2-naphthylamino)-2-oxoethyl](2-hydroxyethyl)amino}-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[1-(3,4-dimethylphenyl)-2-(2-naphthalenylamino)-2-oxoethyl](2-hydroxyethyl)amino]-1-[(4-hydroxyphenyl)methyl]-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 838.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 127.6±3.0 kJ/mol
Flash Point: 460.7±37.1 °C
Index of Refraction: 1.595
Molar Refractivity: 173.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.58
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 3279.38
ACD/KOC (pH 5.5): 9725.31
ACD/LogD (pH 7.4): 4.82
ACD/BCF (pH 7.4): 2129.54
ACD/KOC (pH 7.4): 6315.36
Polar Surface Area: 135 Å2
Polarizability: 68.8±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 511.0±7.0 cm3

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