ChemSpider 2D Image | tert-Butyl 3-cyano-5-methoxypyridin-4-ylcarbamate | C12H15N3O3

tert-Butyl 3-cyano-5-methoxypyridin-4-ylcarbamate

  • Molecular FormulaC12H15N3O3
  • Average mass249.266 Da
  • Monoisotopic mass249.111343 Da
  • ChemSpider ID25072264

More details:

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

(3-Cyano-5-méthoxy-4-pyridinyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1,1-Dimethylethyl N-(3-cyano-5-methoxy-4-pyridinyl)carbamate
1138444-19-5 [RN]
2-Methyl-2-propanyl (3-cyano-5-methoxy-4-pyridinyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3-cyan-5-methoxy-4-pyridinyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(3-cyano-5-methoxy-4-pyridinyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
MFCD11857691 [MDL number]
tert-Butyl 3-cyano-5-methoxypyridin-4-ylcarbamate
tert-butyl N-(3-cyano-5-methoxypyridin-4-yl)carbamate
[1138444-19-5] [RN]
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 341.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.5±3.0 kJ/mol
    Flash Point: 160.4±27.9 °C
    Index of Refraction: 1.528
    Molar Refractivity: 64.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): 2.23
    ACD/BCF (pH 5.5): 28.97
    ACD/KOC (pH 5.5): 387.30
    ACD/LogD (pH 7.4): 2.23
    ACD/BCF (pH 7.4): 28.98
    ACD/KOC (pH 7.4): 387.41
    Polar Surface Area: 84 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 50.5±5.0 dyne/cm
    Molar Volume: 208.5±5.0 cm3

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