ChemSpider 2D Image | MFCD00226926 | C73H108O12

MFCD00226926

  • Molecular FormulaC73H108O12
  • Average mass1177.631 Da
  • Monoisotopic mass1176.784058 Da
  • ChemSpider ID3850163

More details:

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

3,3-Bis(2-{2-[4-hydroxy-3,5-bis(2-méthyl-2-propanyl)phényl]éthoxy}-2-oxoéthyl)pentanedioate de bis{2-[4-hydroxy-3,5-bis(2-méthyl-2-propanyl)phényl]éthyle} [French] [ACD/IUPAC Name]
bis[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl] 3,3-bis{2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethoxy]-2-oxoethyl}pentanedioate
Bis{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethyl} 3,3-bis(2-{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethoxy}-2-oxoethyl)pentanedioate [ACD/IUPAC Name]
Bis{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethyl}-3,3-bis(2-{2-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]ethoxy}-2-oxoethyl)pentandioat [German] [ACD/IUPAC Name]
MFCD00226926
Pentanedioic acid, 3,3-bis[2-[2-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]ethoxy]-2-oxoethyl]-, bis[2-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]ethyl] ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 946.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 142.4±3.0 kJ/mol
Flash Point: 227.7±26.4 °C
Index of Refraction: 1.535
Molar Refractivity: 340.4±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 3
ACD/LogP: 20.60
ACD/LogD (pH 5.5): 19.60
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 19.60
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 186 Å2
Polarizability: 135.0±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 1093.2±3.0 cm3

Click to predict properties on the Chemicalize site


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