ChemSpider 2D Image | 2-Methyl-3-[(2-methyl-3-hexanyl)sulfanyl]hexane | C14H30S

2-Methyl-3-[(2-methyl-3-hexanyl)sulfanyl]hexane

  • Molecular FormulaC14H30S
  • Average mass230.453 Da
  • Monoisotopic mass230.206818 Da
  • ChemSpider ID111258836

More details:

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

2-Methyl-3-[(2-methyl-3-hexanyl)sulfanyl]hexan [German] [ACD/IUPAC Name]
2-Methyl-3-[(2-methyl-3-hexanyl)sulfanyl]hexane [ACD/IUPAC Name]
2-Méthyl-3-[(2-méthyl-3-hexanyl)sulfanyl]hexane [French] [ACD/IUPAC Name]
Hexane, 3,3'-thiobis[2-methyl- [ACD/Index Name]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 273.1±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.1±3.0 kJ/mol
Flash Point: 114.8±10.8 °C
Index of Refraction: 1.456
Molar Refractivity: 74.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.53
ACD/LogD (pH 5.5): 5.90
ACD/BCF (pH 5.5): 17821.20
ACD/KOC (pH 5.5): 38406.77
ACD/LogD (pH 7.4): 5.90
ACD/BCF (pH 7.4): 17821.20
ACD/KOC (pH 7.4): 38406.77
Polar Surface Area: 25 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 27.4±3.0 dyne/cm
Molar Volume: 275.1±3.0 cm3

Click to predict properties on the Chemicalize site


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