ChemSpider 2D Image | Methyl 5-{[(4Z)-4-(3-iodo-4-isopropoxy-5-methoxybenzylidene)-2,5-dioxo-1-imidazolidinyl]methyl}-2-furoate | C21H21IN2O7

Methyl 5-{[(4Z)-4-(3-iodo-4-isopropoxy-5-methoxybenzylidene)-2,5-dioxo-1-imidazolidinyl]methyl}-2-furoate

  • Molecular FormulaC21H21IN2O7
  • Average mass540.305 Da
  • Monoisotopic mass540.039307 Da
  • ChemSpider ID79727143

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Furancarboxylic acid, 5-[[(4Z)-4-[[3-iodo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]-2,5-dioxo-1-imidazolidinyl]methyl]-, methyl ester [ACD/Index Name]
5-{[(4Z)-4-(3-Iodo-4-isopropoxy-5-méthoxybenzylidène)-2,5-dioxo-1-imidazolidinyl]méthyl}-2-furoate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-{[(4Z)-4-(3-iodo-4-isopropoxy-5-methoxybenzylidene)-2,5-dioxo-1-imidazolidinyl]methyl}-2-furoate [ACD/IUPAC Name]
Methyl-5-{[(4Z)-4-(3-iod-4-isopropoxy-5-methoxybenzyliden)-2,5-dioxo-1-imidazolidinyl]methyl}-2-furoat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.628
Molar Refractivity: 120.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 204.66
ACD/KOC (pH 5.5): 1567.58
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 146.99
ACD/KOC (pH 7.4): 1125.80
Polar Surface Area: 107 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 339.0±3.0 cm3

Click to predict properties on the Chemicalize site


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