ChemSpider 2D Image | Ethyl 3-(ethoxycarbonyloxy)-2-(1-(4-tolylsulfinyl)cyclopropyl)-1-pyrrolidinecarboxylate | C20H27NO6S

Ethyl 3-(ethoxycarbonyloxy)-2-(1-(4-tolylsulfinyl)cyclopropyl)-1-pyrrolidinecarboxylate

  • Molecular FormulaC20H27NO6S
  • Average mass409.496 Da
  • Monoisotopic mass409.155914 Da
  • ChemSpider ID20483031

More details:

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

1-Pyrrolidinecarboxylic acid, 3-[(ethoxycarbonyl)oxy]-2-[1-[(4-methylphenyl)sulfinyl]cyclopropyl]-, ethyl ester [ACD/Index Name]
3-[(Éthoxycarbonyl)oxy]-2-{1-[(4-méthylphényl)sulfinyl]cyclopropyl}-1-pyrrolidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(ethoxycarbonyloxy)-2-(1-(4-tolylsulfinyl)cyclopropyl)-1-pyrrolidinecarboxylate
Ethyl 3-[(ethoxycarbonyl)oxy]-2-{1-[(4-methylphenyl)sulfinyl]cyclopropyl}-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
Ethyl-3-[(ethoxycarbonyl)oxy]-2-{1-[(4-methylphenyl)sulfinyl]cyclopropyl}-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
145568-18-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 577.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.8±30.1 °C
Index of Refraction: 1.594
Molar Refractivity: 105.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 75.98
ACD/KOC (pH 5.5): 772.33
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 75.98
ACD/KOC (pH 7.4): 772.33
Polar Surface Area: 101 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 60.0±5.0 dyne/cm
Molar Volume: 311.5±5.0 cm3

Click to predict properties on the Chemicalize site


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