ChemSpider 2D Image | 2-[2-Hydroxy-5-(2-methyl-2-propanyl)-1-benzofuran-3-yl]-4-(2-methyl-2-propanyl)phenyl 4-hydroxy-3,5-bis(2-methyl-2-propanyl)benzoate | C37H46O5

2-[2-Hydroxy-5-(2-methyl-2-propanyl)-1-benzofuran-3-yl]-4-(2-methyl-2-propanyl)phenyl 4-hydroxy-3,5-bis(2-methyl-2-propanyl)benzoate

  • Molecular FormulaC37H46O5
  • Average mass570.758 Da
  • Monoisotopic mass570.334534 Da
  • ChemSpider ID95747070

More details:

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

2-[2-Hydroxy-5-(2-methyl-2-propanyl)-1-benzofuran-3-yl]-4-(2-methyl-2-propanyl)phenyl 4-hydroxy-3,5-bis(2-methyl-2-propanyl)benzoate [ACD/IUPAC Name]
2-[2-Hydroxy-5-(2-methyl-2-propanyl)-1-benzofuran-3-yl]-4-(2-methyl-2-propanyl)phenyl-4-hydroxy-3,5-bis(2-methyl-2-propanyl)benzoat [German] [ACD/IUPAC Name]
4-Hydroxy-3,5-bis(2-méthyl-2-propanyl)benzoate de 2-[2-hydroxy-5-(2-méthyl-2-propanyl)-1-benzofuran-3-yl]-4-(2-méthyl-2-propanyl)phényle [French] [ACD/IUPAC Name]
Benzoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 4-(1,1-dimethylethyl)-2-[5-(1,1-dimethylethyl)-2-hydroxy-3-benzofuranyl]phenyl 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: 676.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 362.7±31.5 °C
Index of Refraction: 1.569
Molar Refractivity: 169.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 11.82
ACD/LogD (pH 5.5): 10.45
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 9.67
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1852870.88
Polar Surface Area: 80 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 518.7±3.0 cm3

Click to predict properties on the Chemicalize site


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