ChemSpider 2D Image | [3-(Butylsulfanyl)phenyl]methanol | C11H16OS

[3-(Butylsulfanyl)phenyl]methanol

  • Molecular FormulaC11H16OS
  • Average mass196.309 Da
  • Monoisotopic mass196.092178 Da
  • ChemSpider ID35327034

More details:

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

[3-(Butylsulfanyl)phenyl]methanol [German] [ACD/IUPAC Name]
[3-(Butylsulfanyl)phenyl]methanol [ACD/IUPAC Name]
[3-(Butylsulfanyl)phényl]méthanol [French] [ACD/IUPAC Name]
1443348-43-3 [RN]
Benzenemethanol, 3-(butylthio)- [ACD/Index Name]
(3-(Butylthio)phenyl)methanol
3-n-Butylthiobenzyl alcohol
atoms 13 bonds 13
MFCD21761054

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

Density: 1.1±0.1 g/cm3
Boiling Point: 321.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 156.6±21.9 °C
Index of Refraction: 1.561
Molar Refractivity: 59.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 116.42
ACD/KOC (pH 5.5): 1048.29
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 116.42
ACD/KOC (pH 7.4): 1048.29
Polar Surface Area: 46 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 43.6±5.0 dyne/cm
Molar Volume: 183.5±5.0 cm3

Click to predict properties on the Chemicalize site


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