ChemSpider 2D Image | Methyl 4-({3-[(Z)-(2,5-dioxo-4-imidazolidinylidene)methyl]-1H-indol-1-yl}methyl)benzoate | C21H17N3O4

Methyl 4-({3-[(Z)-(2,5-dioxo-4-imidazolidinylidene)methyl]-1H-indol-1-yl}methyl)benzoate

  • Molecular FormulaC21H17N3O4
  • Average mass375.377 Da
  • Monoisotopic mass375.121918 Da
  • ChemSpider ID24654191

  • Double-bond stereo - Double-bond stereo

More details:

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

4-({3-[(Z)-(2,5-Dioxo-4-imidazolidinylidène)méthyl]-1H-indol-1-yl}méthyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[3-[(Z)-(2,5-dioxo-4-imidazolidinylidene)methyl]-1H-indol-1-yl]methyl]-, methyl ester [ACD/Index Name]
Methyl 4-({3-[(Z)-(2,5-dioxo-4-imidazolidinylidene)methyl]-1H-indol-1-yl}methyl)benzoate [ACD/IUPAC Name]
Methyl-4-({3-[(Z)-(2,5-dioxo-4-imidazolidinyliden)methyl]-1H-indol-1-yl}methyl)benzoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.675
Molar Refractivity: 103.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 144.76
ACD/KOC (pH 5.5): 1225.16
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 143.73
ACD/KOC (pH 7.4): 1216.42
Polar Surface Area: 89 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 55.5±7.0 dyne/cm
Molar Volume: 274.1±7.0 cm3

Click to predict properties on the Chemicalize site


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