ChemSpider 2D Image | 1-[3-(2,4-Diamino-6-methyl-7-quinazolinyl)phenyl]ethanone | C17H16N4O

1-[3-(2,4-Diamino-6-methyl-7-quinazolinyl)phenyl]ethanone

  • Molecular FormulaC17H16N4O
  • Average mass292.335 Da
  • Monoisotopic mass292.132416 Da
  • ChemSpider ID26328712

More details:

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

1-[3-(2,4-Diamino-6-methyl-7-chinazolinyl)phenyl]ethanon [German] [ACD/IUPAC Name]
1-[3-(2,4-Diamino-6-methyl-7-quinazolinyl)phenyl]ethanone [ACD/IUPAC Name]
1-[3-(2,4-Diamino-6-méthyl-7-quinazolinyl)phényl]éthanone [French] [ACD/IUPAC Name]
1-[3-(2,4-Diamino-6-Methylquinazolin-7-Yl)phenyl]ethanone
Ethanone, 1-[3-(2,4-diamino-6-methyl-7-quinazolinyl)phenyl]- [ACD/Index Name]
Q19

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

Density: 1.3±0.1 g/cm3
Boiling Point: 582.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.2±32.9 °C
Index of Refraction: 1.702
Molar Refractivity: 88.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.90
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 11.41
ACD/KOC (pH 7.4): 128.69
Polar Surface Area: 95 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 65.4±3.0 dyne/cm
Molar Volume: 227.6±3.0 cm3

Click to predict properties on the Chemicalize site


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