ChemSpider 2D Image | Ethyl 4-({[1-(methylsulfonyl)-3-azetidinyl]carbonyl}amino)-1-piperidinecarboxylate | C13H23N3O5S

Ethyl 4-({[1-(methylsulfonyl)-3-azetidinyl]carbonyl}amino)-1-piperidinecarboxylate

  • Molecular FormulaC13H23N3O5S
  • Average mass333.404 Da
  • Monoisotopic mass333.135834 Da
  • ChemSpider ID30744187

More details:

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

1-Piperidinecarboxylic acid, 4-[[[1-(methylsulfonyl)-3-azetidinyl]carbonyl]amino]-, ethyl ester [ACD/Index Name]
4-({[1-(Méthylsulfonyl)-3-azétidinyl]carbonyl}amino)-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({[1-(methylsulfonyl)-3-azetidinyl]carbonyl}amino)-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-({[1-(methylsulfonyl)-3-azetidinyl]carbonyl}amino)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
1428364-80-0 [RN]
ethyl 4-(1-(methylsulfonyl)azetidine-3-carboxamido)piperidine-1-carboxylate
ETHYL 4-(1-METHANESULFONYLAZETIDINE-3-AMIDO)PIPERIDINE-1-CARBOXYLATE

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.563
Molar Refractivity: 80.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.09
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.56
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.56
Polar Surface Area: 104 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 247.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement