ChemSpider 2D Image | Bis[2-(3,5-di-tert-butyl-4-hydroxyphenyl)ethyl] 3,3'-sulfanediyldipropanoate | C38H58O6S

Bis[2-(3,5-di-tert-butyl-4-hydroxyphenyl)ethyl] 3,3'-sulfanediyldipropanoate

  • Molecular FormulaC38H58O6S
  • Average mass642.929 Da
  • Monoisotopic mass642.395386 Da
  • ChemSpider ID97822

More details:

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

260-244-0 [EINECS]
3,3'-Sulfanediyldipropanoate de bis{2-[4-hydroxy-3,5-bis(2-méthyl-2-propanyl)phényl]éthyle} [French] [ACD/IUPAC Name]
56525-25-8 [RN]
Bis(2-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)ethyl) 3,3'-thiobispropionate
Bis[2-(3,5-di-tert-butyl-4-hydroxyphenyl)ethyl] 3,3'-sulfanediyldipropanoate
Bis{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethyl} 3,3'-sulfanediyldipropanoate [ACD/IUPAC Name]
Bis{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethyl}-3,3'-sulfandiyldipropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3,3'-thiobis-, bis(2-(3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)ethyl) ester
Propanoic acid, 3,3'-thiobis-, bis[2-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]ethyl] ester [ACD/Index Name]
2-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)ETHYL 3-({3-[2-(3,5-DI-TERT-BUTYL-4-HYDROXYPHENYL)ETHOXY]-3-OXOPROPYL}SULFANYL)PROPANOATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

BAS 00398912 [DBID]
CDS1_002555 [DBID]
ChemDiv1_018811 [DBID]
DivK1c_003595 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 666.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 356.9±31.5 °C
Index of Refraction: 1.533
Molar Refractivity: 186.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 10.72
ACD/LogD (pH 5.5): 10.34
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.34
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 118 Å2
Polarizability: 73.8±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 599.5±3.0 cm3

Click to predict properties on the Chemicalize site


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