Found 236 results

Search term: MF = 'C_{9}H_{20}OS'
ChemSpider 2D Image | 3-Methyl-4-[(2-methyl-2-propanyl)sulfanyl]-1-butanol | C9H20OS

3-Methyl-4-[(2-methyl-2-propanyl)sulfanyl]-1-butanol

  • Molecular FormulaC9H20OS
  • Average mass176.320 Da
  • Monoisotopic mass176.123489 Da
  • ChemSpider ID57501058

More details:

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

1-Butanol, 4-[(1,1-dimethylethyl)thio]-3-methyl- [ACD/Index Name]
3-Methyl-4-[(2-methyl-2-propanyl)sulfanyl]-1-butanol [German] [ACD/IUPAC Name]
3-Methyl-4-[(2-methyl-2-propanyl)sulfanyl]-1-butanol [ACD/IUPAC Name]
3-Méthyl-4-[(2-méthyl-2-propanyl)sulfanyl]-1-butanol [French] [ACD/IUPAC Name]
62296-22-4 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 244.1±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.9±6.0 kJ/mol
Flash Point: 119.3±21.3 °C
Index of Refraction: 1.475
Molar Refractivity: 53.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 38.15
ACD/KOC (pH 5.5): 471.63
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 38.15
ACD/KOC (pH 7.4): 471.63
Polar Surface Area: 46 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 32.2±3.0 dyne/cm
Molar Volume: 189.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement