ChemSpider 2D Image | 4-[(2-Methoxyethyl)sulfonyl]benzoic acid | C10H12O5S

4-[(2-Methoxyethyl)sulfonyl]benzoic acid

  • Molecular FormulaC10H12O5S
  • Average mass244.264 Da
  • Monoisotopic mass244.040543 Da
  • ChemSpider ID24143841

More details:

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

4-[(2-Methoxyethyl)sulfonyl]benzoesäure [German] [ACD/IUPAC Name]
4-[(2-Methoxyethyl)sulfonyl]benzoic acid [ACD/IUPAC Name]
Acide 4-[(2-méthoxyéthyl)sulfonyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(2-methoxyethyl)sulfonyl]- [ACD/Index Name]
1016888-12-2 [RN]
4-(2-methoxyethanesulfonyl)benzoic acid
4-[(2-methoxyethane)sulfonyl]benzoic acid
MFCD09942739 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 459.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.6±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 57.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.02
ACD/LogD (pH 7.4): -1.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 183.1±3.0 cm3

Click to predict properties on the Chemicalize site


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