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Search term: MF = 'C_{13}H_{24}N_{2}O_{6}S'
ChemSpider 2D Image | 3-[{[4-(Ethoxycarbonyl)-1-piperidinyl]sulfonyl}(methyl)amino]-2-methylpropanoic acid | C13H24N2O6S

3-[{[4-(Ethoxycarbonyl)-1-piperidinyl]sulfonyl}(methyl)amino]-2-methylpropanoic acid

  • Molecular FormulaC13H24N2O6S
  • Average mass336.405 Da
  • Monoisotopic mass336.135498 Da
  • ChemSpider ID54492509

More details:

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

3-[{[4-(Ethoxycarbonyl)-1-piperidinyl]sulfonyl}(methyl)amino]-2-methylpropanoic acid [ACD/IUPAC Name]
3-[{[4-(Ethoxycarbonyl)-1-piperidinyl]sulfonyl}(methyl)amino]-2-methylpropansäure [German] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[[(2-carboxypropyl)methylamino]sulfonyl]-, 4-ethyl ester [ACD/Index Name]
Acide 3-[{[4-(éthoxycarbonyl)-1-pipéridinyl]sulfonyl}(méthyl)amino]-2-méthylpropanoïque [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 493.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 83.3±6.0 kJ/mol
Flash Point: 252.2±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 80.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.30
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.49
ACD/LogD (pH 7.4): -2.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 255.8±5.0 cm3

Click to predict properties on the Chemicalize site


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