ChemSpider 2D Image | 1-{[2-(Methoxycarbonyl)cyclopentyl]sulfonyl}-4-piperidinecarboxylic acid | C13H21NO6S

1-{[2-(Methoxycarbonyl)cyclopentyl]sulfonyl}-4-piperidinecarboxylic acid

  • Molecular FormulaC13H21NO6S
  • Average mass319.374 Da
  • Monoisotopic mass319.108948 Da
  • ChemSpider ID57957194

More details:

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

1-{[2-(Methoxycarbonyl)cyclopentyl]sulfonyl}-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
1-{[2-(Methoxycarbonyl)cyclopentyl]sulfonyl}-4-piperidinecarboxylic acid [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[2-(methoxycarbonyl)cyclopentyl]sulfonyl]- [ACD/Index Name]
Acide 1-{[2-(méthoxycarbonyl)cyclopentyl]sulfonyl}-4-pipéridinecarboxylique [French] [ACD/IUPAC 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: 494.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 83.4±6.0 kJ/mol
Flash Point: 252.7±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 74.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.64
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.79
ACD/LogD (pH 7.4): -2.09
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: 58.4±5.0 dyne/cm
Molar Volume: 231.3±5.0 cm3

Click to predict properties on the Chemicalize site


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