ChemSpider 2D Image | Benzyl (2,2-dimethyl-9-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,15-dioxo-3-oxa-5,9,14-triazahexadecan-16-yl)carbamate | C27H44N4O7

Benzyl (2,2-dimethyl-9-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,15-dioxo-3-oxa-5,9,14-triazahexadecan-16-yl)carbamate

  • Molecular FormulaC27H44N4O7
  • Average mass536.661 Da
  • Monoisotopic mass536.320984 Da
  • ChemSpider ID8825400

More details:

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

(2,2-Diméthyl-9-{[(2-méthyl-2-propanyl)oxy]carbonyl}-4,15-dioxo-3-oxa-5,9,14-triazahexadécan-16-yl)carbamate de benzyle [French] [ACD/IUPAC Name]
Benzyl (2,2-dimethyl-9-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,15-dioxo-3-oxa-5,9,14-triazahexadecan-16-yl)carbamate [ACD/IUPAC Name]
Benzyl-(2,2-dimethyl-9-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,15-dioxo-3-oxa-5,9,14-triazahexadecan-16-yl)carbamat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 716.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 386.8±32.9 °C
Index of Refraction: 1.514
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 479.06
ACD/KOC (pH 5.5): 2885.52
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 478.81
ACD/KOC (pH 7.4): 2884.02
Polar Surface Area: 135 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 477.2±3.0 cm3

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