ChemSpider 2D Image | 2-Methyl-2-propanyl {(1S,2R)-2-[4-(tetrahydro-2H-pyran-2-yloxy)phenyl]cyclopropyl}carbamate | C19H27NO4

2-Methyl-2-propanyl {(1S,2R)-2-[4-(tetrahydro-2H-pyran-2-yloxy)phenyl]cyclopropyl}carbamate

  • Molecular FormulaC19H27NO4
  • Average mass333.422 Da
  • Monoisotopic mass333.194000 Da
  • ChemSpider ID58178476

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

{(1S,2R)-2-[4-(Tétrahydro-2H-pyran-2-yloxy)phényl]cyclopropyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {(1S,2R)-2-[4-(tetrahydro-2H-pyran-2-yloxy)phenyl]cyclopropyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{(1S,2R)-2-[4-(tetrahydro-2H-pyran-2-yloxy)phenyl]cyclopropyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1S,2R)-2-[4-[(tetrahydro-2H-pyran-2-yl)oxy]phenyl]cyclopropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
1946017-76-0 [RN]
2197139-87-8 [RN]
CC(C)(C)OC(=O)N[C@H]1C[C@@H]1C1=CC=C(OC2CCCCO2)C=C1
MFCD30184900
tert-butyl ((1S,2R)-2-(4-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)cyclopropyl)carbamate
tert-Butyl (trans-2-(4-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)cyclopropyl)carbamate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 478.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.3±3.0 kJ/mol
    Flash Point: 243.4±28.7 °C
    Index of Refraction: 1.545
    Molar Refractivity: 91.8±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.90
    ACD/LogD (pH 5.5): 3.25
    ACD/BCF (pH 5.5): 175.04
    ACD/KOC (pH 5.5): 1403.64
    ACD/LogD (pH 7.4): 3.25
    ACD/BCF (pH 7.4): 175.04
    ACD/KOC (pH 7.4): 1403.62
    Polar Surface Area: 57 Å2
    Polarizability: 36.4±0.5 10-24cm3
    Surface Tension: 44.2±5.0 dyne/cm
    Molar Volume: 290.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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