ChemSpider 2D Image | (Z)-1-(4-Chloro-1-ethyl-3-methyl-1H-pyrazol-5-yl)-2-cyano-2-[4-(2-methyl-2-propanyl)phenyl]vinyl pivalate | C24H30ClN3O2

(Z)-1-(4-Chloro-1-ethyl-3-methyl-1H-pyrazol-5-yl)-2-cyano-2-[4-(2-methyl-2-propanyl)phenyl]vinyl pivalate

  • Molecular FormulaC24H30ClN3O2
  • Average mass427.967 Da
  • Monoisotopic mass427.202667 Da
  • ChemSpider ID30656843

  • Double-bond stereo - Double-bond stereo

More details:

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

(Z)-1-(4-Chlor-1-ethyl-3-methyl-1H-pyrazol-5-yl)-2-cyan-2-[4-(2-methyl-2-propanyl)phenyl]vinylpivalat [German] [ACD/IUPAC Name]
(Z)-1-(4-Chloro-1-ethyl-3-methyl-1H-pyrazol-5-yl)-2-cyano-2-[4-(2-methyl-2-propanyl)phenyl]vinyl pivalate [ACD/IUPAC Name]
Pivalate de (Z)-1-(4-chloro-1-éthyl-3-méthyl-1H-pyrazol-5-yl)-2-cyano-2-[4-(2-méthyl-2-propanyl)phényl]vinyle [French] [ACD/IUPAC Name]
Propanoic acid, 2,2-dimethyl-, (Z)-1-(4-chloro-1-ethyl-3-methyl-1H-pyrazol-5-yl)-2-cyano-2-[4-(1,1-dimethylethyl)phenyl]ethenyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 511.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.3±30.1 °C
Index of Refraction: 1.544
Molar Refractivity: 123.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 6.55
ACD/BCF (pH 5.5): 55925.71
ACD/KOC (pH 5.5): 87080.59
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 55925.89
ACD/KOC (pH 7.4): 87080.88
Polar Surface Area: 68 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 35.8±7.0 dyne/cm
Molar Volume: 390.8±7.0 cm3

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