ChemSpider 2D Image | 2-Cyano-N-(3,4-dichlorobenzyl)-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methylacrylamide | C21H23Cl2N3O

2-Cyano-N-(3,4-dichlorobenzyl)-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methylacrylamide

  • Molecular FormulaC21H23Cl2N3O
  • Average mass404.333 Da
  • Monoisotopic mass403.121826 Da
  • ChemSpider ID30645052

More details:

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

2-Cyan-N-(3,4-dichlorbenzyl)-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methylacrylamid [German] [ACD/IUPAC Name]
2-Cyano-N-(3,4-dichlorobenzyl)-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methylacrylamide [ACD/IUPAC Name]
2-Cyano-N-(3,4-dichlorobenzyl)-3-(2,5-diméthyl-1-propyl-1H-pyrrol-3-yl)-N-méthylacrylamide [French] [ACD/IUPAC Name]
2-Propenamide, 2-cyano-N-[(3,4-dichlorophenyl)methyl]-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methyl- [ACD/Index Name]
2-cyano-N-[(3,4-dichlorophenyl)methyl]-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-N-methylprop-2-enamide
875865-16-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 590.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.2±30.1 °C
Index of Refraction: 1.573
Molar Refractivity: 113.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 5.31
ACD/BCF (pH 5.5): 6413.65
ACD/KOC (pH 5.5): 18480.66
ACD/LogD (pH 7.4): 5.31
ACD/BCF (pH 7.4): 6413.65
ACD/KOC (pH 7.4): 18480.66
Polar Surface Area: 49 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 39.7±7.0 dyne/cm
Molar Volume: 344.3±7.0 cm3

Click to predict properties on the Chemicalize site


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