ChemSpider 2D Image | 2-Methyl-2-propanyl {2-[(2-{[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}phenyl)amino]-2-oxoethyl}carbamate | C25H27N5O8

2-Methyl-2-propanyl {2-[(2-{[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}phenyl)amino]-2-oxoethyl}carbamate

  • Molecular FormulaC25H27N5O8
  • Average mass525.511 Da
  • Monoisotopic mass525.185974 Da
  • ChemSpider ID34636388

More details:

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

{2-[(2-{[4-(5-Nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}phényl)amino]-2-oxoéthyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {2-[(2-{[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}phenyl)amino]-2-oxoethyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{2-[(2-{[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}phenyl)amino]-2-oxoethyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[2-[[4-(1,3-dihydro-5-nitro-1,3-dioxo-2H-isoindol-2-yl)-1-oxobutyl]amino]phenyl]amino]-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 805.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.2±3.0 kJ/mol
Flash Point: 441.1±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 134.8±0.3 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.79
ACD/KOC (pH 5.5): 459.59
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.78
ACD/KOC (pH 7.4): 459.37
Polar Surface Area: 180 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 68.5±3.0 dyne/cm
Molar Volume: 373.9±3.0 cm3

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