ChemSpider 2D Image | 1-[(1Z)-1-[3-(2,4-Dichlorophenoxy)propoxy]-1-(2,4-difluorophenyl)-1-propen-2-yl]-1H-1,2,4-triazole | C20H17Cl2F2N3O2

1-[(1Z)-1-[3-(2,4-Dichlorophenoxy)propoxy]-1-(2,4-difluorophenyl)-1-propen-2-yl]-1H-1,2,4-triazole

  • Molecular FormulaC20H17Cl2F2N3O2
  • Average mass440.271 Da
  • Monoisotopic mass439.066589 Da
  • ChemSpider ID30657754

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(1Z)-1-[3-(2,4-Dichlorophenoxy)propoxy]-1-(2,4-difluorophenyl)-1-propen-2-yl]-1H-1,2,4-triazole [ACD/IUPAC Name]
1-[(1Z)-1-[3-(2,4-Dichlorophénoxy)propoxy]-1-(2,4-difluorophényl)-1-propén-2-yl]-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
1-[(1Z)-1-[3-(2,4-Dichlorphenoxy)propoxy]-1-(2,4-difluorphenyl)-1-propen-2-yl]-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
1H-1,2,4-Triazole, 1-[(Z)-2-[3-(2,4-dichlorophenoxy)propoxy]-2-(2,4-difluorophenyl)-1-methylethenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 551.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.5±32.9 °C
Index of Refraction: 1.582
Molar Refractivity: 108.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.93
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8833.74
ACD/KOC (pH 5.5): 23236.81
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8838.24
ACD/KOC (pH 7.4): 23248.66
Polar Surface Area: 49 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 41.2±7.0 dyne/cm
Molar Volume: 325.6±7.0 cm3

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