ChemSpider 2D Image | Diethyl [(methylsulfonyl)amino]malonate | C8H15NO6S

Diethyl [(methylsulfonyl)amino]malonate

  • Molecular FormulaC8H15NO6S
  • Average mass253.273 Da
  • Monoisotopic mass253.062012 Da
  • ChemSpider ID26054264

More details:

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

[(Méthylsulfonyl)amino]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(methylsulfonyl)amino]malonate [ACD/IUPAC Name]
Diethyl-[(methylsulfonyl)amino]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-[(methylsulfonyl)amino]-, diethyl ester [ACD/Index Name]
1,3-diethyl 2-methanesulfonamidopropanedioate
117975-99-2 [RN]
MFCD12087318

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

Density: 1.3±0.1 g/cm3
Boiling Point: 353.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.8±3.0 kJ/mol
Flash Point: 167.5±30.7 °C
Index of Refraction: 1.471
Molar Refractivity: 55.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.70
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.93
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.77
Polar Surface Area: 107 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 197.8±3.0 cm3

Click to predict properties on the Chemicalize site


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