ChemSpider 2D Image | 1-({[1-(Methoxycarbonyl)cyclopentyl]methyl}sulfonyl)proline | C13H21NO6S

1-({[1-(Methoxycarbonyl)cyclopentyl]methyl}sulfonyl)proline

  • Molecular FormulaC13H21NO6S
  • Average mass319.374 Da
  • Monoisotopic mass319.108948 Da
  • ChemSpider ID57729273

More details:

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

1-({[1-(Methoxycarbonyl)cyclopentyl]methyl}sulfonyl)prolin [German] [ACD/IUPAC Name]
1-({[1-(Methoxycarbonyl)cyclopentyl]methyl}sulfonyl)proline [ACD/IUPAC Name]
1-({[1-(Méthoxycarbonyl)cyclopentyl]méthyl}sulfonyl)proline [French] [ACD/IUPAC Name]
Proline, 1-[[[1-(methoxycarbonyl)cyclopentyl]methyl]sulfonyl]- [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: 487.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 82.5±6.0 kJ/mol
Flash Point: 248.8±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 74.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.73
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 230.5±5.0 cm3

Click to predict properties on the Chemicalize site


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