ChemSpider 2D Image | (6-Fluoro-3-methyl-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl)acetic acid | C11H9FN2O4

(6-Fluoro-3-methyl-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl)acetic acid

  • Molecular FormulaC11H9FN2O4
  • Average mass252.199 Da
  • Monoisotopic mass252.054642 Da
  • ChemSpider ID57252453

More details:






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

(6-Fluor-3-methyl-2,4-dioxo-3,4-dihydro-1(2H)-chinazolinyl)essigsäure [German] [ACD/IUPAC Name]
(6-Fluoro-3-methyl-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl)acetic acid [ACD/IUPAC Name]
1(2H)-Quinazolineacetic acid, 6-fluoro-3,4-dihydro-3-methyl-2,4-dioxo- [ACD/Index Name]
Acide (6-fluoro-3-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-quinazolinyl)acétique [French] [ACD/IUPAC Name]
(6-Fluoro-3-methyl-2,4-dioxo-3,4-dihydro-2H-quinazolin-1-yl)-acetic acid
MFCD29479381

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

Density: 1.5±0.1 g/cm3
Boiling Point: 462.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 233.6±31.5 °C
Index of Refraction: 1.592
Molar Refractivity: 56.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): -0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.42
ACD/LogD (pH 7.4): -2.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 167.8±3.0 cm3

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