ChemSpider 2D Image | 2-(3-Chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1(2H)-phthalazinone | C24H17ClN4O4

2-(3-Chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1(2H)-phthalazinone

  • Molecular FormulaC24H17ClN4O4
  • Average mass460.869 Da
  • Monoisotopic mass460.093842 Da
  • ChemSpider ID25185194

More details:

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

1(2H)-Phthalazinone, 2-(3-chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]- [ACD/Index Name]
2-(3-Chlorophényl)-4-[3-(3,5-diméthoxyphényl)-1,2,4-oxadiazol-5-yl]-1(2H)-phtalazinone [French] [ACD/IUPAC Name]
2-(3-Chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1(2H)-phthalazinone [ACD/IUPAC Name]
2-(3-Chlorphenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1(2H)-phthalazinon [German] [ACD/IUPAC Name]
[1291857-25-4] [RN]
1291857-25-4 [RN]
2-(3-chlorophenyl)-4-(3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)phthalazin-1(2H)-one
2-(3-Chloro-phenyl)-4-[3-(3,5-dimethoxy-phenyl)-[1,2,4]oxadiazol-5-yl]-2H-phthalazin-1-one
2-(3-chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1,2-dihydrophthalazin-1-one
2-(3-chlorophenyl)-4-[3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]phthalazin-1(2H)-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 701.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.9±35.7 °C
Index of Refraction: 1.679
Molar Refractivity: 122.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1187.62
ACD/KOC (pH 5.5): 5526.53
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1187.62
ACD/KOC (pH 7.4): 5526.53
Polar Surface Area: 90 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 53.0±7.0 dyne/cm
Molar Volume: 325.2±7.0 cm3

Click to predict properties on the Chemicalize site


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