ChemSpider 2D Image | 3-{[3-(2-Methoxyethoxy)propyl]sulfonyl}propanoic acid | C9H18O6S

3-{[3-(2-Methoxyethoxy)propyl]sulfonyl}propanoic acid

  • Molecular FormulaC9H18O6S
  • Average mass254.301 Da
  • Monoisotopic mass254.082413 Da
  • ChemSpider ID52633587

More details:

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

3-{[3-(2-Methoxyethoxy)propyl]sulfonyl}propanoic acid [ACD/IUPAC Name]
3-{[3-(2-Methoxyethoxy)propyl]sulfonyl}propansäure [German] [ACD/IUPAC Name]
Acide 3-{[3-(2-méthoxyéthoxy)propyl]sulfonyl}propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[[3-(2-methoxyethoxy)propyl]sulfonyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 469.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 80.2±6.0 kJ/mol
Flash Point: 237.9±25.9 °C
Index of Refraction: 1.473
Molar Refractivity: 57.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -2.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 205.5±3.0 cm3

Click to predict properties on the Chemicalize site


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