ChemSpider 2D Image | 2,5-Bis[(4-butoxybenzoyl)oxy]benzoic acid | C29H30O8

2,5-Bis[(4-butoxybenzoyl)oxy]benzoic acid

  • Molecular FormulaC29H30O8
  • Average mass506.544 Da
  • Monoisotopic mass506.194061 Da
  • ChemSpider ID35303093

More details:

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

2,5-Bis[(4-butoxybenzoyl)oxy]benzoesäure [German] [ACD/IUPAC Name]
2,5-Bis[(4-butoxybenzoyl)oxy]benzoic acid [ACD/IUPAC Name]
Acide 2,5-bis[(4-butoxybenzoyl)oxy]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2,5-bis[(4-butoxybenzoyl)oxy]- [ACD/Index Name]
2,5-bis(4-butoxybenzoyloxy)benzoic acid
2,5-Bis[(4-butoxybenzoyl)oxy]-benzoic acid
205689-93-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 702.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 108.0±3.0 kJ/mol
Flash Point: 230.3±26.4 °C
Index of Refraction: 1.576
Molar Refractivity: 137.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 8.31
ACD/LogD (pH 5.5): 4.27
ACD/BCF (pH 5.5): 236.91
ACD/KOC (pH 5.5): 303.26
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 80.87
ACD/KOC (pH 7.4): 103.52
Polar Surface Area: 108 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 415.8±3.0 cm3

Click to predict properties on the Chemicalize site


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