ChemSpider 2D Image | 5,6,7,8-Tetrahydropyrido[3,4-d]pyrimidine | C7H9N3

5,6,7,8-Tetrahydropyrido[3,4-d]pyrimidine

  • Molecular FormulaC7H9N3
  • Average mass135.167 Da
  • Monoisotopic mass135.079651 Da
  • ChemSpider ID10739737

More details:

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

5,6,7,8-Tetrahydropyrido[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
5,6,7,8-Tetrahydropyrido[3,4-d]pyrimidine [ACD/IUPAC Name]
5,6,7,8-Tétrahydropyrido[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
781595-43-5 [RN]
Pyrido[3,4-d]pyrimidine, 5,6,7,8-tetrahydro- [ACD/Index Name]
5,6,7,8-Tetrahydro-pyrido[3,4-d]pyrimidine
5H,6H,7H,8H-pyrido[3,4-d]pyrimidine
MFCD08703280 [MDL number]
PYRIDO[3,4-D]PYRIMIDINE,5,6,7,8-TETRAHYDRO-

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 277.1±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.6±3.0 kJ/mol
    Flash Point: 121.4±24.6 °C
    Index of Refraction: 1.552
    Molar Refractivity: 38.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -1.15
    ACD/LogD (pH 5.5): -1.67
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.46
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 12.15
    Polar Surface Area: 38 Å2
    Polarizability: 15.0±0.5 10-24cm3
    Surface Tension: 49.3±3.0 dyne/cm
    Molar Volume: 118.7±3.0 cm3

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