ChemSpider 2D Image | (2E,4Z)-5-(1,3-Benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)-2,4-pentadienamide | C18H21NO4

(2E,4Z)-5-(1,3-Benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)-2,4-pentadienamide

  • Molecular FormulaC18H21NO4
  • Average mass315.364 Da
  • Monoisotopic mass315.147064 Da
  • ChemSpider ID23311286

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4Z)-5-(1,3-Benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)-2,4-pentadienamid [German] [ACD/IUPAC Name]
(2E,4Z)-5-(1,3-Benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)-2,4-pentadienamide [ACD/IUPAC Name]
(2E,4Z)-5-(1,3-Benzodioxol-5-yl)-N-(2,2-diméthyl-3-oxobutyl)-2,4-pentadiénamide [French] [ACD/IUPAC Name]
(2E,4Z)-5-(1,3-benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)penta-2,4-dienamide
2,4-Pentadienamide, 5-(1,3-benzodioxol-5-yl)-N-(2,2-dimethyl-3-oxobutyl)-, (2E,4Z)- [ACD/Index Name]
5-(8,9-methylenedioxy)-2-trans-4-cis-pentadienyl-N-(2'-acetoxy-2'-methylpropyl)amide.
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL442424/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 537.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.8±30.1 °C
Index of Refraction: 1.573
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 21.94
ACD/KOC (pH 5.5): 317.45
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 21.94
ACD/KOC (pH 7.4): 317.45
Polar Surface Area: 65 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 270.4±3.0 cm3

Click to predict properties on the Chemicalize site


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