ChemSpider 2D Image | 8-(4-Ethoxyphenyl)-9-(4-hydroxyphenyl)-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one | C20H17N7O3

8-(4-Ethoxyphenyl)-9-(4-hydroxyphenyl)-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one

  • Molecular FormulaC20H17N7O3
  • Average mass403.394 Da
  • Monoisotopic mass403.139282 Da
  • ChemSpider ID22752189

More details:

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

8-(4-Ethoxyphenyl)-9-(4-hydroxyphenyl)-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-on [German] [ACD/IUPAC Name]
8-(4-Ethoxyphenyl)-9-(4-hydroxyphenyl)-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one [ACD/IUPAC Name]
8-(4-Éthoxyphényl)-9-(4-hydroxyphényl)-1,9-dihydrotétrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one [French] [ACD/IUPAC Name]
Tetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol, 8-(4-ethoxyphenyl)-4,9-dihydro-9-(4-hydroxyphenyl)- [ACD/Index Name]
5-(4-Ethoxy-phenyl)-4-(4-hydroxy-phenyl)-4,9-dihydro-1,2,3,3a,6,7,9-heptaaza-cyclopenta[b]naphthalen-8-ol
8-(4-ethoxyphenyl)-9-(4-hydroxyphenyl)-4,9,10-trihydropyridazino[4,5-d]1,2,3,4-tetraazolo[1,5-a]pyrimidin-5-ol
8-(4-ethoxyphenyl)-9-(4-hydroxyphenyl)-4,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol

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

Density: 1.6±0.1 g/cm3
Boiling Point: 675.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 362.6±34.3 °C
Index of Refraction: 1.799
Molar Refractivity: 107.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.42
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.41
Polar Surface Area: 131 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 70.9±7.0 dyne/cm
Molar Volume: 251.0±7.0 cm3

Click to predict properties on the Chemicalize site


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