ChemSpider 2D Image | 4-[(E)-2-(3,5-Dimethoxyphenyl)vinyl]phenyl 5-acetoxy-2-[(sulfamoyloxy)methyl]benzoate | C26H25NO9S

4-[(E)-2-(3,5-Dimethoxyphenyl)vinyl]phenyl 5-acetoxy-2-[(sulfamoyloxy)methyl]benzoate

  • Molecular FormulaC26H25NO9S
  • Average mass527.543 Da
  • Monoisotopic mass527.125000 Da
  • ChemSpider ID9607382

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[(E)-2-(3,5-Dimethoxyphenyl)vinyl]phenyl 5-acetoxy-2-[(sulfamoyloxy)methyl]benzoate [ACD/IUPAC Name]
4-[(E)-2-(3,5-Dimethoxyphenyl)vinyl]phenyl-5-acetoxy-2-[(sulfamoyloxy)methyl]benzoat [German] [ACD/IUPAC Name]
5-Acétoxy-2-[(sulfamoyloxy)méthyl]benzoate de 4-[(E)-2-(3,5-diméthoxyphényl)vinyl]phényle [French] [ACD/IUPAC Name]
Benzoic acid, 5-(acetyloxy)-2-[[(aminosulfonyl)oxy]methyl]-, 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenyl ester [ACD/Index 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: 740.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.0±3.0 kJ/mol
Flash Point: 401.7±35.7 °C
Index of Refraction: 1.608
Molar Refractivity: 134.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 832.88
ACD/KOC (pH 5.5): 4286.63
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 812.55
ACD/KOC (pH 7.4): 4181.98
Polar Surface Area: 149 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 55.7±3.0 dyne/cm
Molar Volume: 389.1±3.0 cm3

Click to predict properties on the Chemicalize site


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