ChemSpider 2D Image | Isopropyl 2-[(4-{[2-furoyl(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate | C25H27NO8S

Isopropyl 2-[(4-{[2-furoyl(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

  • Molecular FormulaC25H27NO8S
  • Average mass501.549 Da
  • Monoisotopic mass501.145752 Da
  • ChemSpider ID29236720

More details:

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

2-[(4-{[2-Furoyl(2-méthoxyéthyl)amino]méthyl}phénoxy)sulfonyl]benzoate d'isopropyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[4-[[(2-furanylcarbonyl)(2-methoxyethyl)amino]methyl]phenoxy]sulfonyl]-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 2-[(4-{[2-furoyl(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate [ACD/IUPAC Name]
Isopropyl-2-[(4-{[2-furoyl(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoat [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: 665.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 356.1±31.5 °C
Index of Refraction: 1.568
Molar Refractivity: 128.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 473.78
ACD/KOC (pH 5.5): 2862.74
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 473.78
ACD/KOC (pH 7.4): 2862.74
Polar Surface Area: 121 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 392.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement