ChemSpider 2D Image | 2,4-Dioxo-1,2,3,4-tetrahydro-7-quinazolinecarbonitrile | C9H5N3O2

2,4-Dioxo-1,2,3,4-tetrahydro-7-quinazolinecarbonitrile

  • Molecular FormulaC9H5N3O2
  • Average mass187.155 Da
  • Monoisotopic mass187.038177 Da
  • ChemSpider ID28599859

More details:

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

2,4-Dioxo-1,2,3,4-tetrahydro-7-chinazolincarbonitril [German] [ACD/IUPAC Name]
2,4-Dioxo-1,2,3,4-tetrahydro-7-quinazolinecarbonitrile [ACD/IUPAC Name]
2,4-Dioxo-1,2,3,4-tétrahydro-7-quinazolinecarbonitrile [French] [ACD/IUPAC Name]
2,4-Dioxo-1,2,3,4-tetrahydroquinazoline-7-carbonitrile
7-Quinazolinecarbonitrile, 1,2,3,4-tetrahydro-2,4-dioxo- [ACD/Index Name]
864292-20-6 [RN]
[864292-20-6] [RN]
2,4-dihydroxyquinazoline-7-carbonitrile
2,4-dioxo-1H-quinazoline-7-carbonitrile
MFCD20040096
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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: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.670
    Molar Refractivity: 46.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.66
    ACD/LogD (pH 5.5): 0.59
    ACD/BCF (pH 5.5): 1.64
    ACD/KOC (pH 5.5): 49.62
    ACD/LogD (pH 7.4): 0.58
    ACD/BCF (pH 7.4): 1.62
    ACD/KOC (pH 7.4): 49.03
    Polar Surface Area: 82 Å2
    Polarizability: 18.3±0.5 10-24cm3
    Surface Tension: 78.4±5.0 dyne/cm
    Molar Volume: 123.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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