ChemSpider 2D Image | tert-Butyl (2-{[1-(1,3-benzodioxol-5-yl)-2-(tert-butylamino)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate | C26H35N3O7

tert-Butyl (2-{[1-(1,3-benzodioxol-5-yl)-2-(tert-butylamino)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate

  • Molecular FormulaC26H35N3O7
  • Average mass501.572 Da
  • Monoisotopic mass501.247498 Da
  • ChemSpider ID10481872

More details:






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

[2-({1-(1,3-Benzodioxol-5-yl)-2-[(2-méthyl-2-propanyl)amino]-2-oxoéthyl}[(5-méthyl-2-furyl)méthyl]amino)-2-oxoéthyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [2-({1-(1,3-benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}[(5-methyl-2-furyl)methyl]amino)-2-oxoethyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[2-({1-(1,3-benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}[(5-methyl-2-furyl)methyl]amino)-2-oxoethyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[1-(1,3-benzodioxol-5-yl)-2-[(1,1-dimethylethyl)amino]-2-oxoethyl][(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl (2-{[1-(1,3-benzodioxol-5-yl)-2-(tert-butylamino)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate
tert-butyl (2-{[1-(1,3-benzodioxol-5-yl)-2-(tert-butylamino)-2-oxoethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)carbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 689.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 370.8±31.5 °C
Index of Refraction: 1.549
Molar Refractivity: 131.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 297.76
ACD/KOC (pH 5.5): 2053.03
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 297.68
ACD/KOC (pH 7.4): 2052.50
Polar Surface Area: 119 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 414.7±3.0 cm3

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