ChemSpider 2D Image | 4-tert-Butylbenzoic anhydride | C22H26O3

4-tert-Butylbenzoic anhydride

  • Molecular FormulaC22H26O3
  • Average mass338.440 Da
  • Monoisotopic mass338.188202 Da
  • ChemSpider ID24533925

More details:

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

1X1&1&R DVOVR DX1&1&1 [WLN]
22201-45-2 [RN]
4-(2-Methyl-2-propanyl)benzoesäureanhydrid [German] [ACD/IUPAC Name]
4-(2-Methyl-2-propanyl)benzoic anhydride [ACD/IUPAC Name]
4-tert-Butylbenzoic anhydride
Anhydride 4-(2-méthyl-2-propanyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-tert-butyl, anhydride
Benzoic acid, p-tert-butyl, anhydride
(4-Tert-butylbenzoyl) 4-tert-butylbenzoate
4-(tert-butyl)benzoic anhydride
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 455.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.5±3.0 kJ/mol
Flash Point: 209.0±22.9 °C
Index of Refraction: 1.536
Molar Refractivity: 99.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.40
ACD/LogD (pH 5.5): 5.82
ACD/BCF (pH 5.5): 15555.28
ACD/KOC (pH 5.5): 34844.43
ACD/LogD (pH 7.4): 5.82
ACD/BCF (pH 7.4): 15555.28
ACD/KOC (pH 7.4): 34844.43
Polar Surface Area: 43 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 320.1±3.0 cm3

Click to predict properties on the Chemicalize site


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