ChemSpider 2D Image | (E)-2-Cyano-2-[4-(2-methyl-2-propanyl)phenyl]-1-(3-methyl-1-vinyl-1H-pyrazol-5-yl)vinyl pivalate | C24H29N3O2

(E)-2-Cyano-2-[4-(2-methyl-2-propanyl)phenyl]-1-(3-methyl-1-vinyl-1H-pyrazol-5-yl)vinyl pivalate

  • Molecular FormulaC24H29N3O2
  • Average mass391.506 Da
  • Monoisotopic mass391.225983 Da
  • ChemSpider ID30657324

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-2-Cyan-2-[4-(2-methyl-2-propanyl)phenyl]-1-(3-methyl-1-vinyl-1H-pyrazol-5-yl)vinylpivalat [German] [ACD/IUPAC Name]
(E)-2-Cyano-2-[4-(2-methyl-2-propanyl)phenyl]-1-(3-methyl-1-vinyl-1H-pyrazol-5-yl)vinyl pivalate [ACD/IUPAC Name]
Pivalate de (E)-2-cyano-2-[4-(2-méthyl-2-propanyl)phényl]-1-(3-méthyl-1-vinyl-1H-pyrazol-5-yl)vinyle [French] [ACD/IUPAC Name]
Propanoic acid, 2,2-dimethyl-, (E)-2-cyano-2-[4-(1,1-dimethylethyl)phenyl]-1-(1-ethenyl-3-methyl-1H-pyrazol-5-yl)ethenyl ester [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 447.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 224.7±28.7 °C
Index of Refraction: 1.535
Molar Refractivity: 118.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.05
ACD/LogD (pH 5.5): 6.10
ACD/BCF (pH 5.5): 25463.75
ACD/KOC (pH 5.5): 49582.48
ACD/LogD (pH 7.4): 6.10
ACD/BCF (pH 7.4): 25467.05
ACD/KOC (pH 7.4): 49588.90
Polar Surface Area: 68 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 34.8±7.0 dyne/cm
Molar Volume: 381.5±7.0 cm3

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