ChemSpider 2D Image | 2-(Allylsulfonyl)propanoic acid | C6H10O4S

2-(Allylsulfonyl)propanoic acid

  • Molecular FormulaC6H10O4S
  • Average mass178.206 Da
  • Monoisotopic mass178.029984 Da
  • ChemSpider ID25905852

More details:

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

2-(Allylsulfonyl)propanoic acid [ACD/IUPAC Name]
2-(Allylsulfonyl)propansäure [German] [ACD/IUPAC Name]
Acide 2-(allylsulfonyl)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-(2-propen-1-ylsulfonyl)- [ACD/Index Name]
1267339-84-3 [RN]
2-(prop-2-ene-1-sulfonyl)propanoic acid
MFCD19259667
NS-01528

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

Density: 1.3±0.1 g/cm3
Boiling Point: 388.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.1±6.0 kJ/mol
Flash Point: 189.0±25.9 °C
Index of Refraction: 1.489
Molar Refractivity: 40.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.05
ACD/LogD (pH 5.5): -2.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 138.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement