ChemSpider 2D Image | 6-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-1-(1-hydroxyvinyl)-3-[(3-pyridinylmethyl)amino]-3,4-dihydro-2(1H)-quinazolinone | C19H15F7N4O2

6-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-1-(1-hydroxyvinyl)-3-[(3-pyridinylmethyl)amino]-3,4-dihydro-2(1H)-quinazolinone

  • Molecular FormulaC19H15F7N4O2
  • Average mass464.337 Da
  • Monoisotopic mass464.108337 Da
  • ChemSpider ID95729459

More details:

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

2(1H)-Quinazolinone, 3,4-dihydro-1-(1-hydroxyethenyl)-3-[(3-pyridinylmethyl)amino]-6-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]- [ACD/Index Name]
6-(1,1,1,2,3,3,3-Heptafluor-2-propanyl)-1-(1-hydroxyvinyl)-3-[(3-pyridinylmethyl)amino]-3,4-dihydro-2(1H)-chinazolinon [German] [ACD/IUPAC Name]
6-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-1-(1-hydroxyvinyl)-3-[(3-pyridinylmethyl)amino]-3,4-dihydro-2(1H)-quinazolinone [ACD/IUPAC Name]
6-(1,1,1,2,3,3,3-Heptafluoro-2-propanyl)-1-(1-hydroxyvinyl)-3-[(3-pyridinylméthyl)amino]-3,4-dihydro-2(1H)-quinazolinone [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 486.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 247.8±31.5 °C
Index of Refraction: 1.565
Molar Refractivity: 97.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 68.23
ACD/KOC (pH 5.5): 682.63
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 74.59
ACD/KOC (pH 7.4): 746.31
Polar Surface Area: 69 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 51.1±5.0 dyne/cm
Molar Volume: 299.9±5.0 cm3

Click to predict properties on the Chemicalize site


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