ChemSpider 2D Image | 2-Methyl-2-propanyl (1-{sec-butyl[1-(3-methylphenyl)-2-(2-naphthylamino)-2-oxoethyl]amino}-4-methyl-1-oxo-2-pentanyl)carbamate | C34H45N3O4

2-Methyl-2-propanyl (1-{sec-butyl[1-(3-methylphenyl)-2-(2-naphthylamino)-2-oxoethyl]amino}-4-methyl-1-oxo-2-pentanyl)carbamate

  • Molecular FormulaC34H45N3O4
  • Average mass559.739 Da
  • Monoisotopic mass559.341003 Da
  • ChemSpider ID16537801

More details:






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

(1-{sec-Butyl[1-(3-méthylphényl)-2-(2-naphtylamino)-2-oxoéthyl]amino}-4-méthyl-1-oxo-2-pentanyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (1-{sec-butyl[1-(3-methylphenyl)-2-(2-naphthylamino)-2-oxoethyl]amino}-4-methyl-1-oxo-2-pentanyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1-{sec-butyl[1-(3-methylphenyl)-2-(2-naphthylamino)-2-oxoethyl]amino}-4-methyl-1-oxo-2-pentanyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-methyl-1-[[[1-(3-methylphenyl)-2-(2-naphthalenylamino)-2-oxoethyl](1-methylpropyl)amino]carbonyl]butyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 706.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 381.2±35.7 °C
Index of Refraction: 1.558
Molar Refractivity: 164.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 9.59
ACD/LogD (pH 5.5): 6.19
ACD/BCF (pH 5.5): 25697.32
ACD/KOC (pH 5.5): 41731.03
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 18129.29
ACD/KOC (pH 7.4): 29440.97
Polar Surface Area: 95 Å2
Polarizability: 65.3±0.5 10-24cm3
Surface Tension: 38.0±7.0 dyne/cm
Molar Volume: 510.4±7.0 cm3

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