Found 53 results

Search term: MF = 'C_{21}H_{19}NO_{7}S_{2}'
ChemSpider 2D Image | 5-{[(2-{[3-(Ethoxycarbonyl)-4-phenyl-2-thienyl]amino}-2-oxoethyl)sulfinyl]methyl}-2-furoic acid | C21H19NO7S2

5-{[(2-{[3-(Ethoxycarbonyl)-4-phenyl-2-thienyl]amino}-2-oxoethyl)sulfinyl]methyl}-2-furoic acid

  • Molecular FormulaC21H19NO7S2
  • Average mass461.508 Da
  • Monoisotopic mass461.060303 Da
  • ChemSpider ID60196130

More details:

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

2-Furancarboxylic acid, 5-[[[2-[[3-(ethoxycarbonyl)-4-phenyl-2-thienyl]amino]-2-oxoethyl]sulfinyl]methyl]- [ACD/Index Name]
5-{[(2-{[3-(Ethoxycarbonyl)-4-phenyl-2-thienyl]amino}-2-oxoethyl)sulfinyl]methyl}-2-furoesäure [German] [ACD/IUPAC Name]
5-{[(2-{[3-(Ethoxycarbonyl)-4-phenyl-2-thienyl]amino}-2-oxoethyl)sulfinyl]methyl}-2-furoic acid [ACD/IUPAC Name]
Acide 5-{[(2-{[3-(éthoxycarbonyl)-4-phényl-2-thiényl]amino}-2-oxoéthyl)sulfinyl]méthyl}-2-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 782.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.4±3.0 kJ/mol
Flash Point: 427.1±32.9 °C
Index of Refraction: 1.669
Molar Refractivity: 117.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.62
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.36
Polar Surface Area: 170 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 71.2±3.0 dyne/cm
Molar Volume: 313.7±3.0 cm3

Click to predict properties on the Chemicalize site


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