ChemSpider 2D Image | 4-[1-(3,4-Dimethylbenzoyl)-1,2,3,6-tetrahydro-4-pyridinyl]phenyl (2E)-3-(2,4-dichlorophenyl)acrylate | C29H25Cl2NO3

4-[1-(3,4-Dimethylbenzoyl)-1,2,3,6-tetrahydro-4-pyridinyl]phenyl (2E)-3-(2,4-dichlorophenyl)acrylate

  • Molecular FormulaC29H25Cl2NO3
  • Average mass506.420 Da
  • Monoisotopic mass505.121155 Da
  • ChemSpider ID112588111

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(2,4-Dichlorophényl)acrylate de 4-[1-(3,4-diméthylbenzoyl)-1,2,3,6-tétrahydro-4-pyridinyl]phényle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 4-[1-(3,4-dimethylbenzoyl)-1,2,3,6-tetrahydro-4-pyridinyl]phenyl ester, (2E)- [ACD/Index Name]
4-[1-(3,4-Dimethylbenzoyl)-1,2,3,6-tetrahydro-4-pyridinyl]phenyl (2E)-3-(2,4-dichlorophenyl)acrylate [ACD/IUPAC Name]
4-[1-(3,4-Dimethylbenzoyl)-1,2,3,6-tetrahydro-4-pyridinyl]phenyl-(2E)-3-(2,4-dichlorphenyl)acrylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 695.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.4±31.5 °C
Index of Refraction: 1.642
Molar Refractivity: 141.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.54
ACD/LogD (pH 5.5): 6.78
ACD/BCF (pH 5.5): 82982.73
ACD/KOC (pH 5.5): 115502.41
ACD/LogD (pH 7.4): 6.78
ACD/BCF (pH 7.4): 82982.73
ACD/KOC (pH 7.4): 115502.41
Polar Surface Area: 47 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 392.9±3.0 cm3

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