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Search term: XXGVNOZZUWANRD-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 1,6-Dimethyl-3-[4-(trifluoromethoxy)phenyl]pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione | C14H10F3N5O3

1,6-Dimethyl-3-[4-(trifluoromethoxy)phenyl]pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione

  • Molecular FormulaC14H10F3N5O3
  • Average mass353.256 Da
  • Monoisotopic mass353.073578 Da
  • ChemSpider ID30821078

More details:

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

1,6-Dimethyl-3-[4-(trifluormethoxy)phenyl]pyrimido[5,4-e][1,2,4]triazin-5,7(1H,6H)-dion [German] [ACD/IUPAC Name]
1,6-Dimethyl-3-[4-(trifluoromethoxy)phenyl]pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione [ACD/IUPAC Name]
1,6-Diméthyl-3-[4-(trifluorométhoxy)phényl]pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione [French] [ACD/IUPAC Name]
Pyrimido[5,4-e]-1,2,4-triazine-5,7(1H,6H)-dione, 1,6-dimethyl-3-[4-(trifluoromethoxy)phenyl]- [ACD/Index Name]
1,6-Dimethyl-3-(4-(trifluoromethoxy)phenyl)pyrimido[5,4-e][1,2,4]triazine-5,7(1H,6H)-dione
1448806-43-6 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 382.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 185.4±30.7 °C
Index of Refraction: 1.635
Molar Refractivity: 79.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.86
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.19
ACD/KOC (pH 5.5): 39.51
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.19
ACD/KOC (pH 7.4): 39.51
Polar Surface Area: 87 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 221.5±7.0 cm3

Click to predict properties on the Chemicalize site


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