ChemSpider 2D Image | tert-butyl N-({2H,4H,5H,7H-pyrano[3,4-c]pyrazol-7-yl}methyl)carbamate | C12H19N3O3

tert-butyl N-({2H,4H,5H,7H-pyrano[3,4-c]pyrazol-7-yl}methyl)carbamate

  • Molecular FormulaC12H19N3O3
  • Average mass253.298 Da
  • Monoisotopic mass253.142639 Da
  • ChemSpider ID48064164

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

(2,4,5,7-Tétrahydropyrano[3,4-c]pyrazol-7-ylméthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1445951-11-0 [RN]
2-Methyl-2-propanyl (2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-7-ylmethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-7-ylmethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-7-yl)methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl N-({2H,4H,5H,7H-pyrano[3,4-c]pyrazol-7-yl}methyl)carbamate
MFCD25509366
N1=C2C(=CN1)CCOC2CNC(=O)OC(C)(C)C
t-Butyl ((2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-7-yl)methyl)carbamate
tert-Butyl ((2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-7-yl)methyl)carbamate
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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: 461.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.3±3.0 kJ/mol
    Flash Point: 233.0±25.9 °C
    Index of Refraction: 1.524
    Molar Refractivity: 65.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.11
    ACD/LogD (pH 5.5): 1.61
    ACD/BCF (pH 5.5): 9.92
    ACD/KOC (pH 5.5): 179.78
    ACD/LogD (pH 7.4): 1.62
    ACD/BCF (pH 7.4): 9.94
    ACD/KOC (pH 7.4): 180.18
    Polar Surface Area: 76 Å2
    Polarizability: 26.1±0.5 10-24cm3
    Surface Tension: 47.2±3.0 dyne/cm
    Molar Volume: 214.8±3.0 cm3

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