ChemSpider 2D Image | Dimethyl (2S,2'S)-2,2'-(sulfonyldiimino)dipropanoate | C8H16N2O6S

Dimethyl (2S,2'S)-2,2'-(sulfonyldiimino)dipropanoate

  • Molecular FormulaC8H16N2O6S
  • Average mass268.287 Da
  • Monoisotopic mass268.072906 Da
  • ChemSpider ID18957863

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,2'S)-2,2'-(Sulfonyldiimino)dipropanoate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl (2S,2'S)-2,2'-(sulfonyldiimino)dipropanoate [ACD/IUPAC Name]
Dimethyl-(2S,2'S)-2,2'-(sulfonyldiimino)dipropanoat [German] [ACD/IUPAC Name]
323178-08-1 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL501961/
methyl (2S)-2-({[(2S)-1-methoxy-1-oxopropan-2-yl]sulfamoyl}amino)propanoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 370.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 178.1±30.7 °C
Index of Refraction: 1.481
Molar Refractivity: 58.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.24
ACD/LogD (pH 5.5): -0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.17
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.33
Polar Surface Area: 119 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 207.0±3.0 cm3

Click to predict properties on the Chemicalize site


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