ChemSpider 2D Image | 2-Methyl-2-propanyl [(2R)-2-hydroxy-2-phenylethyl][2-(4-nitrophenyl)ethyl]carbamate | C21H26N2O5

2-Methyl-2-propanyl [(2R)-2-hydroxy-2-phenylethyl][2-(4-nitrophenyl)ethyl]carbamate

  • Molecular FormulaC21H26N2O5
  • Average mass386.441 Da
  • Monoisotopic mass386.184174 Da
  • ChemSpider ID29788889

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(2R)-2-Hydroxy-2-phényléthyl][2-(4-nitrophényl)éthyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(2R)-2-hydroxy-2-phenylethyl][2-(4-nitrophenyl)ethyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(2R)-2-hydroxy-2-phenylethyl][2-(4-nitrophenyl)ethyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(2R)-2-hydroxy-2-phenylethyl]-N-[2-(4-nitrophenyl)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
(N-tert-Butoxycarbonyl-N-[(1?R)-hydroxy-1-phenyl)ethyl])-4-nitrophenylethylamine
(N-tert-Butoxycarbonyl-N-[(1'R)-hydroxy-1-phenyl)ethyl])-4-nitrophenylethylamine
(R)-tert-Butyl (2-hydroxy-2-phenylethyl)(4-nitrophenethyl)carbamate
[(2R)-2-Hydroxy-2-phenylethyl][2-(4-nitrophenyl)ethyl]carbamic acid 1,1-dimethylethyl ester
223673-35-6 [RN]
DS-11494
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 543.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.4±3.0 kJ/mol
    Flash Point: 282.2±30.1 °C
    Index of Refraction: 1.580
    Molar Refractivity: 106.3±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.74
    ACD/LogD (pH 5.5): 4.19
    ACD/BCF (pH 5.5): 894.41
    ACD/KOC (pH 5.5): 4511.39
    ACD/LogD (pH 7.4): 4.19
    ACD/BCF (pH 7.4): 894.41
    ACD/KOC (pH 7.4): 4511.39
    Polar Surface Area: 96 Å2
    Polarizability: 42.1±0.5 10-24cm3
    Surface Tension: 50.4±3.0 dyne/cm
    Molar Volume: 319.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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