ChemSpider 2D Image | 2-Methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine | C8H11N3

2-Methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

  • Molecular FormulaC8H11N3
  • Average mass149.193 Da
  • Monoisotopic mass149.095291 Da
  • ChemSpider ID26528072

More details:

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

2-Methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
2-Methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine [ACD/IUPAC Name]
2-Méthyl-5,6,7,8-tétrahydropyrido[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidine, 5,6,7,8-tetrahydro-2-methyl- [ACD/Index Name]
1159882-42-4 [RN]
2-Methyl-5,6,7,8-tetrahydro-pyrido[3,4-d]pyrimidine
2-methyl-5H,6H,7H,8H-pyrido[3,4-d]pyrimidine
MFCD18916740 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 268.9±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±3.0 kJ/mol
    Flash Point: 116.5±24.6 °C
    Index of Refraction: 1.546
    Molar Refractivity: 42.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -0.86
    ACD/LogD (pH 5.5): -1.38
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 18.41
    Polar Surface Area: 38 Å2
    Polarizability: 17.0±0.5 10-24cm3
    Surface Tension: 46.3±3.0 dyne/cm
    Molar Volume: 135.0±3.0 cm3

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