ChemSpider 2D Image | 7-Benzyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-one | C14H15N3O

7-Benzyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-one

  • Molecular FormulaC14H15N3O
  • Average mass241.288 Da
  • Monoisotopic mass241.121506 Da
  • ChemSpider ID21402913

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

7-Benzyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-on [German] [ACD/IUPAC Name]
7-Benzyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(4aH)-one [ACD/IUPAC Name]
7-Benzyl-5,6,7,8-tétrahydropyrido[3,4-d]pyrimidin-4(4aH)-one [French] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidin-4(4aH)-one, 5,6,7,8-tetrahydro-7-(phenylmethyl)- [ACD/Index Name]
[1053656-41-9] [RN]
1053656-41-9 [RN]
62458-96-2 [RN]
7-benzyl-4a,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
7-BENZYL-4AH,5H,6H,8H-PYRIDO[3,4-D]PYRIMIDIN-4-ONE
7-benzyl-4H,4aH,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 376.5±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.4±3.0 kJ/mol
    Flash Point: 181.5±30.7 °C
    Index of Refraction: 1.662
    Molar Refractivity: 70.3±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.68
    ACD/LogD (pH 5.5): 1.12
    ACD/BCF (pH 5.5): 3.50
    ACD/KOC (pH 5.5): 68.60
    ACD/LogD (pH 7.4): 1.45
    ACD/BCF (pH 7.4): 7.43
    ACD/KOC (pH 7.4): 145.63
    Polar Surface Area: 45 Å2
    Polarizability: 27.9±0.5 10-24cm3
    Surface Tension: 51.9±7.0 dyne/cm
    Molar Volume: 190.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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