ChemSpider 2D Image | Benzyl N-[(benzyloxy)carbonyl]-N-(13,13-dimethyl-9-{2-[(2-methyl-2-propanyl)oxy]-2-oxoethyl}-11-oxo-3,6,12-trioxa-9-azatetradec-1-yl)glycinate | C35H50N2O10

Benzyl N-[(benzyloxy)carbonyl]-N-(13,13-dimethyl-9-{2-[(2-methyl-2-propanyl)oxy]-2-oxoethyl}-11-oxo-3,6,12-trioxa-9-azatetradec-1-yl)glycinate

  • Molecular FormulaC35H50N2O10
  • Average mass658.779 Da
  • Monoisotopic mass658.346558 Da
  • ChemSpider ID9279419

More details:

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

Benzyl N-[(benzyloxy)carbonyl]-N-(13,13-dimethyl-9-{2-[(2-methyl-2-propanyl)oxy]-2-oxoethyl}-11-oxo-3,6,12-trioxa-9-azatetradec-1-yl)glycinate [ACD/IUPAC Name]
Benzyl-N-[(benzyloxy)carbonyl]-N-(13,13-dimethyl-9-{2-[(2-methyl-2-propanyl)oxy]-2-oxoethyl}-11-oxo-3,6,12-trioxa-9-azatetradec-1-yl)glycinat [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-N-(13,13-diméthyl-9-{2-[(2-méthyl-2-propanyl)oxy]-2-oxoéthyl}-11-oxo-3,6,12-trioxa-9-azatétradéc-1-yl)glycinate de benzyle [French] [ACD/IUPAC 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: 690.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.4±31.5 °C
Index of Refraction: 1.527
Molar Refractivity: 175.5±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 3
ACD/LogP: 7.19
ACD/LogD (pH 5.5): 6.39
ACD/BCF (pH 5.5): 42050.32
ACD/KOC (pH 5.5): 70666.66
ACD/LogD (pH 7.4): 6.40
ACD/BCF (pH 7.4): 42749.72
ACD/KOC (pH 7.4): 71842.02
Polar Surface Area: 130 Å2
Polarizability: 69.6±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 570.8±3.0 cm3

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