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Search term: CXAQLKBZAORQNK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | tert-decanethiol | C10H22S

tert-decanethiol

  • Molecular FormulaC10H22S
  • Average mass174.347 Da
  • Monoisotopic mass174.144226 Da
  • ChemSpider ID11564019

More details:

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

2-Methyl-2-nonanethiol [ACD/IUPAC Name]
2-Méthyl-2-nonanethiol [French] [ACD/IUPAC Name]
2-Methyl-2-nonanthiol [German] [ACD/IUPAC Name]
2-Nonanethiol, 2-methyl- [ACD/Index Name]
30174-58-4 [RN]
tert-decanethiol
2-Methylnonane-2-thiol
t-decylmercaptan

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

Density: 0.8±0.1 g/cm3
Boiling Point: 217.3±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.5±3.0 kJ/mol
Flash Point: 71.7±18.6 °C
Index of Refraction: 1.454
Molar Refractivity: 56.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 5.35
ACD/BCF (pH 5.5): 6857.05
ACD/KOC (pH 5.5): 19386.44
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 6856.40
ACD/KOC (pH 7.4): 19384.63
Polar Surface Area: 39 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 27.8±3.0 dyne/cm
Molar Volume: 207.7±3.0 cm3

Click to predict properties on the Chemicalize site


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