ChemSpider 2D Image | 1-{3-[(1-Ethyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-methylpropanoyl}proline | C15H22N2O6S

1-{3-[(1-Ethyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-methylpropanoyl}proline

  • Molecular FormulaC15H22N2O6S
  • Average mass358.410 Da
  • Monoisotopic mass358.119843 Da
  • ChemSpider ID28594207

More details:

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

1-{3-[(1-Ethyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-methylpropanoyl}prolin [German] [ACD/IUPAC Name]
1-{3-[(1-Ethyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-methylpropanoyl}proline [ACD/IUPAC Name]
1-{3-[(1-Éthyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-méthylpropanoyl}proline [French] [ACD/IUPAC Name]
Proline, 1-[3-[(1-ethyl-2,5-dioxo-3-pyrrolidinyl)sulfinyl]-2-methyl-1-oxopropyl]- [ACD/Index Name]
1-{3-[(1-ETHYL-2,5-DIOXOPYRROLIDIN-3-YL)SULFINYL]-2-METHYLPROPANOYL}-L-PROLINE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 706.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 112.5±6.0 kJ/mol
Flash Point: 380.9±32.9 °C
Index of Refraction: 1.608
Molar Refractivity: 86.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.92
ACD/LogD (pH 5.5): -3.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 131 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 73.8±5.0 dyne/cm
Molar Volume: 248.7±5.0 cm3

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