ChemSpider 2D Image | 1-{2-[Methyl(methylsulfonyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid | C9H16N2O5S

1-{2-[Methyl(methylsulfonyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC9H16N2O5S
  • Average mass264.299 Da
  • Monoisotopic mass264.078003 Da
  • ChemSpider ID29615335

More details:

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

1-{2-[Methyl(methylsulfonyl)amino]ethyl}-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-{2-[Methyl(methylsulfonyl)amino]ethyl}-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[2-[methyl(methylsulfonyl)amino]ethyl]-5-oxo- [ACD/Index Name]
Acide 1-{2-[méthyl(méthylsulfonyl)amino]éthyl}-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1-[2-(N-METHYLMETHANESULFONAMIDO)ETHYL]-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID
1-{2-[methyl(methylsulfonyl)amino]ethyl}-5-oxopyrrolidine-3-carboxylic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 511.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 85.7±6.0 kJ/mol
Flash Point: 263.2±32.9 °C
Index of Refraction: 1.553
Molar Refractivity: 60.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -2.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 187.4±3.0 cm3

Click to predict properties on the Chemicalize site


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