ChemSpider 2D Image | (1R)-1-(Methylsulfonyl)-1,2-propanediol | C4H10O4S

(1R)-1-(Methylsulfonyl)-1,2-propanediol

  • Molecular FormulaC4H10O4S
  • Average mass154.185 Da
  • Monoisotopic mass154.029984 Da
  • ChemSpider ID24541226

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(1R)-1-(Methylsulfonyl)-1,2-propandiol [German] [ACD/IUPAC Name]
(1R)-1-(Methylsulfonyl)-1,2-propanediol [ACD/IUPAC Name]
(1R)-1-(Méthylsulfonyl)-1,2-propanediol [French] [ACD/IUPAC Name]
1,2-Propanediol, 1-(methylsulfonyl)-, (1R)- [ACD/Index Name]
(1R)-1-(methylsulfonyl)propane-1,2-diol
(R)-1-(MESYL)-1,2-PROPANEDIOL
1217512-95-2 [RN]
R-1-Mesyl-1,2-propanediol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 409.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.4±6.0 kJ/mol
Flash Point: 201.3±25.9 °C
Index of Refraction: 1.494
Molar Refractivity: 32.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.39
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.59
ACD/LogD (pH 7.4): -1.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.58
Polar Surface Area: 83 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 111.4±3.0 cm3

Click to predict properties on the Chemicalize site


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