ChemSpider 2D Image | 4-[(Methylsulfonyl)methyl]phenol | C8H10O3S

4-[(Methylsulfonyl)methyl]phenol

  • Molecular FormulaC8H10O3S
  • Average mass186.228 Da
  • Monoisotopic mass186.035065 Da
  • ChemSpider ID27027525

More details:

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

342403-17-2 [RN]
4-(Methylsulfonylmethyl)phenol
4-[(Methylsulfonyl)methyl]phenol [German] [ACD/IUPAC Name]
4-[(Methylsulfonyl)methyl]phenol [ACD/IUPAC Name]
4-[(Méthylsulfonyl)méthyl]phénol [French] [ACD/IUPAC Name]
MFCD24721524
Phenol, 4-[(methylsulfonyl)methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 432.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.5±3.0 kJ/mol
Flash Point: 215.5±24.0 °C
Index of Refraction: 1.568
Molar Refractivity: 46.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.44
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.26
Polar Surface Area: 63 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 52.8±3.0 dyne/cm
Molar Volume: 141.7±3.0 cm3

Click to predict properties on the Chemicalize site


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