ChemSpider 2D Image | 3-(Methoxymethyl)-6-(methylsulfonyl)-3-hexanol | C9H20O4S

3-(Methoxymethyl)-6-(methylsulfonyl)-3-hexanol

  • Molecular FormulaC9H20O4S
  • Average mass224.318 Da
  • Monoisotopic mass224.108231 Da
  • ChemSpider ID48454703

More details:

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

3-(Methoxymethyl)-6-(methylsulfonyl)-3-hexanol [German] [ACD/IUPAC Name]
3-(Methoxymethyl)-6-(methylsulfonyl)-3-hexanol [ACD/IUPAC Name]
3-(Méthoxyméthyl)-6-(méthylsulfonyl)-3-hexanol [French] [ACD/IUPAC Name]
3-Hexanol, 3-(methoxymethyl)-6-(methylsulfonyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 393.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 74.4±6.0 kJ/mol
Flash Point: 191.9±25.1 °C
Index of Refraction: 1.465
Molar Refractivity: 55.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.60
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.56
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.56
Polar Surface Area: 72 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 39.0±3.0 dyne/cm
Molar Volume: 202.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement