ChemSpider 2D Image | Dodecyl octadecyl 3,3'-sulfanediyldipropanoate | C36H70O4S

Dodecyl octadecyl 3,3'-sulfanediyldipropanoate

  • Molecular FormulaC36H70O4S
  • Average mass599.004 Da
  • Monoisotopic mass598.499451 Da
  • ChemSpider ID75008

More details:

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

13103-52-1 [RN]
236-025-0 [EINECS]
3,3'-Sulfanediyldipropanoate de dodécyle et d'octadécyle [French] [ACD/IUPAC Name]
Dodecyl octadecyl 3,3'-sulfanediyldipropanoate [ACD/IUPAC Name]
Dodecyl-octadecyl-3,3'-sulfandiyldipropanoat [German] [ACD/IUPAC Name]
Octadecyl 3-((3-(dodecyloxy)-3-oxopropyl)thio)propionate
Octadecyl 3-[[3-(dodecyloxy)-3-oxopropyl]thio]propanoate
octadecyl 3-[[3-(dodecyloxy)-3-oxopropyl]thio]propionate
Propanoic acid, 3-((3-(dodecyloxy)-3-oxopropyl)thio)-, octadecyl ester
Propanoic acid, 3,3'-thiobis-, dodecyl octadecyl ester [ACD/Index Name]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 645.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.2±3.0 kJ/mol
Flash Point: 295.3±15.4 °C
Index of Refraction: 1.472
Molar Refractivity: 180.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 16.07
ACD/LogD (pH 5.5): 15.15
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.15
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 78 Å2
Polarizability: 71.5±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 643.7±3.0 cm3

Click to predict properties on the Chemicalize site


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