ChemSpider 2D Image | 2-Methyl-2-propanyl [33-amino-2,13,19,30-tetraoxo-3,12,20,29-tetraoxatricyclo[29.3.1.1~14,18~]hexatriaconta-1(35),14(36),15,17,31,33-hexaen-16-yl]carbamate | C37H50N2O10

2-Methyl-2-propanyl [33-amino-2,13,19,30-tetraoxo-3,12,20,29-tetraoxatricyclo[29.3.1.114,18]hexatriaconta-1(35),14(36),15,17,31,33-hexaen-16-yl]carbamate

  • Molecular FormulaC37H50N2O10
  • Average mass682.800 Da
  • Monoisotopic mass682.346558 Da
  • ChemSpider ID9094757

More details:






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

[33-Amino-2,13,19,30-tétraoxo-3,12,20,29-tétraoxatricyclo[29.3.1.114,18]hexatriaconta-1(35),14(36),15,17,31,33-hexaén-16-yl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [33-amino-2,13,19,30-tetraoxo-3,12,20,29-tetraoxatricyclo[29.3.1.114,18]hexatriaconta-1(35),14(36),15,17,31,33-hexaen-16-yl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[33-amino-2,13,19,30-tetraoxo-3,12,20,29-tetraoxatricyclo[29.3.1.114,18]hexatriaconta-1(35),14(36),15,17,31,33-hexaen-16-yl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[33-amino-2,13,19,30-tetraoxo-3,12,20,29-tetraoxatricyclo[29.3.1.114,18]hexatriaconta-1(35),14,16,18(36),31,33-hexaen-16-yl]-, 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: 883.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 128.4±3.0 kJ/mol
Flash Point: 488.1±34.3 °C
Index of Refraction: 1.523
Molar Refractivity: 182.5±0.3 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 3
ACD/LogP: 5.62
ACD/LogD (pH 5.5): 6.83
ACD/BCF (pH 5.5): 91119.82
ACD/KOC (pH 5.5): 123481.35
ACD/LogD (pH 7.4): 6.83
ACD/BCF (pH 7.4): 91169.95
ACD/KOC (pH 7.4): 123549.30
Polar Surface Area: 170 Å2
Polarizability: 72.3±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 597.8±3.0 cm3

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