ChemSpider 2D Image | nonyl 3-mercaptopropionate | C12H24O2S

nonyl 3-mercaptopropionate

  • Molecular FormulaC12H24O2S
  • Average mass232.383 Da
  • Monoisotopic mass232.149704 Da
  • ChemSpider ID29361792

More details:

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

3-Sulfanylpropanoate de 7-méthyloctyle [French] [ACD/IUPAC Name]
67231-93-0 [RN]
7-Methyloctyl 3-sulfanylpropanoate [ACD/IUPAC Name]
7-Methyloctyl-3-sulfanylpropanoat [German] [ACD/IUPAC Name]
nonyl 3-mercaptopropionate
Propanoic acid, 3-mercapto-, 7-methyloctyl ester [ACD/Index Name]
45163-99-3 [RN]
56841-50-0 [RN]
ISONONYL MERCAPTOPROPIONATE

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

Density: 0.9±0.1 g/cm3
Boiling Point: 303.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 162.7±11.1 °C
Index of Refraction: 1.462
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 4.81
ACD/BCF (pH 5.5): 2646.28
ACD/KOC (pH 5.5): 9806.40
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2631.89
ACD/KOC (pH 7.4): 9753.07
Polar Surface Area: 65 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 32.4±3.0 dyne/cm
Molar Volume: 244.5±3.0 cm3

Click to predict properties on the Chemicalize site


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