ChemSpider 2D Image | TERT-BUTYL N-(5-BROMOPYRIDIN-2-YL)-N-PROPYLCARBAMATE | C13H19BrN2O2

TERT-BUTYL N-(5-BROMOPYRIDIN-2-YL)-N-PROPYLCARBAMATE

  • Molecular FormulaC13H19BrN2O2
  • Average mass315.206 Da
  • Monoisotopic mass314.062988 Da
  • ChemSpider ID26525692

More details:

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

(5-Bromo-2-pyridinyl)propylcarbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1280786-95-9 [RN]
2-Methyl-2-propanyl (5-bromo-2-pyridinyl)propylcarbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(5-brom-2-pyridinyl)propylcarbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(5-bromo-2-pyridinyl)-N-propyl-, 1,1-dimethylethyl ester [ACD/Index Name]
TERT-BUTYL N-(5-BROMOPYRIDIN-2-YL)-N-PROPYLCARBAMATE
[1280786-95-9] [RN]
2-(N-BOC-N-PROPYLAMINO)-5-BROMOPYRIDINE
MFCD18783202 [MDL number]
PY-1838
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 367.9±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.3±23.7 °C
    Index of Refraction: 1.547
    Molar Refractivity: 75.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.58
    ACD/LogD (pH 5.5): 3.57
    ACD/BCF (pH 5.5): 302.77
    ACD/KOC (pH 5.5): 2077.47
    ACD/LogD (pH 7.4): 3.57
    ACD/BCF (pH 7.4): 302.91
    ACD/KOC (pH 7.4): 2078.39
    Polar Surface Area: 42 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 42.8±3.0 dyne/cm
    Molar Volume: 239.4±3.0 cm3

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