ChemSpider 2D Image | tert-Butyl 4-(hydroxymethyl)-3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-5(4H)-carboxylate | C13H21N3O3

tert-Butyl 4-(hydroxymethyl)-3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-5(4H)-carboxylate

  • Molecular FormulaC13H21N3O3
  • Average mass267.324 Da
  • Monoisotopic mass267.158295 Da
  • ChemSpider ID28601028

More details:

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

1251017-76-1 [RN]
2-Methyl-2-propanyl 4-(hydroxymethyl)-3-methyl-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(hydroxymethyl)-3-methyl-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-carboxylat [German] [ACD/IUPAC Name]
4-(Hydroxyméthyl)-3-méthyl-3,4,6,7-tétrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
5H-Imidazo[4,5-c]pyridine-5-carboxylic acid, 3,4,6,7-tetrahydro-4-(hydroxymethyl)-3-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 4-(hydroxymethyl)-3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-5(4H)-carboxylate
4-Hydroxymethyl-3-methyl-3,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid t-butyl ester
4-Hydroxymethyl-3-methyl-3,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
4-hydroxymethyl-3-methyl-3,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester(wx140178)
AM805362
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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: 461.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.1±3.0 kJ/mol
    Flash Point: 233.1±28.7 °C
    Index of Refraction: 1.579
    Molar Refractivity: 71.2±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.19
    ACD/LogD (pH 5.5): 0.07
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.44
    ACD/LogD (pH 7.4): 0.82
    ACD/BCF (pH 7.4): 2.46
    ACD/KOC (pH 7.4): 65.10
    Polar Surface Area: 68 Å2
    Polarizability: 28.2±0.5 10-24cm3
    Surface Tension: 43.5±7.0 dyne/cm
    Molar Volume: 214.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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