ChemSpider 2D Image | Dimethyl 3,3'-(sulfonyldiimino)dipropanoate | C8H16N2O6S

Dimethyl 3,3'-(sulfonyldiimino)dipropanoate

  • Molecular FormulaC8H16N2O6S
  • Average mass268.287 Da
  • Monoisotopic mass268.072906 Da
  • ChemSpider ID24690714

More details:

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

3,3'-(Sulfonyldiimino)dipropanoate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 3,3'-(sulfonyldiimino)dipropanoate [ACD/IUPAC Name]
Dimethyl-3,3'-(sulfonyldiimino)dipropanoat [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL461137/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 388.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.6±30.7 °C
Index of Refraction: 1.483
Molar Refractivity: 58.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.29
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.22
Polar Surface Area: 119 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 206.2±3.0 cm3

Click to predict properties on the Chemicalize site


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