ChemSpider 2D Image | 2,4-Dihydroxyquinazoline-5-carbonitrile | C9H5N3O2

2,4-Dihydroxyquinazoline-5-carbonitrile

  • Molecular FormulaC9H5N3O2
  • Average mass187.155 Da
  • Monoisotopic mass187.038177 Da
  • ChemSpider ID29737809

More details:

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

1823958-91-3 [RN]
2,4-Dihydroxyquinazoline-5-carbonitrile
2,4-Dioxo-1,2,3,4-tetrahydro-5-chinazolincarbonitril [German] [ACD/IUPAC Name]
2,4-Dioxo-1,2,3,4-tetrahydro-5-quinazolinecarbonitrile [ACD/IUPAC Name]
2,4-Dioxo-1,2,3,4-tétrahydro-5-quinazolinecarbonitrile [French] [ACD/IUPAC Name]
5-Quinazolinecarbonitrile, 1,2,3,4-tetrahydro-2,4-dioxo- [ACD/Index Name]
MFCD27922742

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

Density: 1.6±0.1 g/cm3
Boiling Point: 583.2±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 306.5±30.9 °C
Index of Refraction: 1.770
Molar Refractivity: 47.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.29
ACD/LogD (pH 5.5): -2.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 90 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 121.1±5.0 dyne/cm
Molar Volume: 114.4±5.0 cm3

Click to predict properties on the Chemicalize site


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