ChemSpider 2D Image | 2-Methyl-2-propanyl {1-[4-(benzyloxy)phenyl]-4-chloro-3-oxo-2-butanyl}carbamate | C22H26ClNO4

2-Methyl-2-propanyl {1-[4-(benzyloxy)phenyl]-4-chloro-3-oxo-2-butanyl}carbamate

  • Molecular FormulaC22H26ClNO4
  • Average mass403.899 Da
  • Monoisotopic mass403.155029 Da
  • ChemSpider ID24022103

More details:

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

{1-[4-(Benzyloxy)phényl]-4-chloro-3-oxo-2-butanyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {1-[4-(benzyloxy)phenyl]-4-chloro-3-oxo-2-butanyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{1-[4-(benzyloxy)phenyl]-4-chlor-3-oxo-2-butanyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-chloro-2-oxo-1-[[4-(phenylmethoxy)phenyl]methyl]propyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
1279852-20-8 [RN]
MFCD28023844
tert-butyl 1-(4-(benzyloxy)phenyl)-4-chloro-3-oxobutan-2-ylcarbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 549.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 285.9±30.1 °C
Index of Refraction: 1.550
Molar Refractivity: 109.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1521.14
ACD/KOC (pH 5.5): 6597.71
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1520.53
ACD/KOC (pH 7.4): 6595.10
Polar Surface Area: 65 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 343.7±3.0 cm3

Click to predict properties on the Chemicalize site


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