ChemSpider 2D Image | ditridecyl 3,3'-thiodipropanoate | C32H62O4S

ditridecyl 3,3'-thiodipropanoate

  • Molecular FormulaC32H62O4S
  • Average mass542.897 Da
  • Monoisotopic mass542.436890 Da
  • ChemSpider ID74676

More details:

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

10595-72-9 [RN]
234-206-9 [EINECS]
3,3'-Sulfanediyldipropanoate de ditridécyle [French] [ACD/IUPAC Name]
Ditridecyl 3,3'-sulfanediyldipropanoate [ACD/IUPAC Name]
ditridecyl 3,3'-thiodipropanoate
Ditridecyl-3,3'-sulfandiyldipropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3,3'-thiobis-, ditridecyl ester [ACD/Index Name]
3,3'-Thiobispropanoic acid, ditridecyl ester
3,3'-Thiodipropionic acid ditridecyl ester
3-[(3-keto-3-tridecoxy-propyl)thio]propionic acid tridecyl ester

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


Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 602.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 275.2±15.4 °C
Index of Refraction: 1.472
Molar Refractivity: 161.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 13.95
ACD/LogD (pH 5.5): 13.45
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.45
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 78 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 577.7±3.0 cm3

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