ChemSpider 2D Image | 2-Methyl-2-propanyl (2-{1-[3-(5-methyl-2-nitrophenoxy)propanoyl]-4-piperidinyl}tetrahydro-2H-pyran-4-yl)carbamate | C25H37N3O7

2-Methyl-2-propanyl (2-{1-[3-(5-methyl-2-nitrophenoxy)propanoyl]-4-piperidinyl}tetrahydro-2H-pyran-4-yl)carbamate

  • Molecular FormulaC25H37N3O7
  • Average mass491.577 Da
  • Monoisotopic mass491.263153 Da
  • ChemSpider ID81151735

More details:

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

(2-{1-[3-(5-Méthyl-2-nitrophénoxy)propanoyl]-4-pipéridinyl}tétrahydro-2H-pyran-4-yl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (2-{1-[3-(5-methyl-2-nitrophenoxy)propanoyl]-4-piperidinyl}tetrahydro-2H-pyran-4-yl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2-{1-[3-(5-methyl-2-nitrophenoxy)propanoyl]-4-piperidinyl}tetrahydro-2H-pyran-4-yl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[tetrahydro-2-[1-[3-(5-methyl-2-nitrophenoxy)-1-oxopropyl]-4-piperidinyl]-2H-pyran-4-yl]-, 1,1-dimethylethyl ester [ACD/Index 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: 681.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 365.7±31.5 °C
Index of Refraction: 1.559
Molar Refractivity: 129.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 598.94
ACD/KOC (pH 5.5): 3385.75
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 598.93
ACD/KOC (pH 7.4): 3385.69
Polar Surface Area: 123 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 52.0±5.0 dyne/cm
Molar Volume: 401.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement