ChemSpider 2D Image | (Octylsulfanyl)acetonitrile | C10H19NS

(Octylsulfanyl)acetonitrile

  • Molecular FormulaC10H19NS
  • Average mass185.330 Da
  • Monoisotopic mass185.123825 Da
  • ChemSpider ID23497366

More details:

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

(Octylsulfanyl)acetonitril [German] [ACD/IUPAC Name]
(Octylsulfanyl)acetonitrile [ACD/IUPAC Name]
(Octylsulfanyl)acétonitrile [French] [ACD/IUPAC Name]
Acetonitrile, 2-(octylthio)- [ACD/Index Name]
2-(OCTYLSULFANYL)ACETONITRILE
2-octylthioethanenitrile
Octylsulfanyl-acetonitrile

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

Density: 0.9±0.1 g/cm3
Boiling Point: 274.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.3±3.0 kJ/mol
Flash Point: 120.0±22.6 °C
Index of Refraction: 1.472
Molar Refractivity: 56.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 4.10
ACD/BCF (pH 5.5): 765.41
ACD/KOC (pH 5.5): 4035.47
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 765.41
ACD/KOC (pH 7.4): 4035.47
Polar Surface Area: 49 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 201.0±3.0 cm3

Click to predict properties on the Chemicalize site


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