ChemSpider 2D Image | S,S'-[1,1'-Bi(cyclohexyl)-4,4'-diylbis(methylene)] diethanethioate | C18H30O2S2

S,S'-[1,1'-Bi(cyclohexyl)-4,4'-diylbis(methylene)] diethanethioate

  • Molecular FormulaC18H30O2S2
  • Average mass342.560 Da
  • Monoisotopic mass342.168732 Da
  • ChemSpider ID29334687

More details:






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

Diéthanethioate de S,S'-[1,1'-bi(cyclohexyl)-4,4'-diyldiméthylène] [French] [ACD/IUPAC Name]
Ethanethioic acid, S,S'-[[1,1'-bicyclohexyl]-4,4'-diylbis(methylene)] ester [ACD/Index Name]
S,S'-[1,1'-Bi(cyclohexyl)-4,4'-diylbis(methylene)] diethanethioate [ACD/IUPAC Name]
S,S'-[1,1'-Bi(cyclohexyl)-4,4'-diyldimethylen]-diethanthioat [German] [ACD/IUPAC Name]
trans,trans-S,S’-bi(cyclohexane)-4,4’-diylbis(methylene)diethanethioate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 451.2±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 181.2±11.3 °C
Index of Refraction: 1.527
Molar Refractivity: 97.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.80
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8751.52
ACD/KOC (pH 5.5): 23085.18
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8751.52
ACD/KOC (pH 7.4): 23085.18
Polar Surface Area: 85 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 316.9±3.0 cm3

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