ChemSpider 2D Image | 4-(4-Hexylbenzoyl)phenyl acetate | C21H24O3

4-(4-Hexylbenzoyl)phenyl acetate

  • Molecular FormulaC21H24O3
  • Average mass324.414 Da
  • Monoisotopic mass324.172546 Da
  • ChemSpider ID21397691

More details:

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

4-(4-Hexylbenzoyl)phenyl acetate [ACD/IUPAC Name]
4-(4-Hexylbenzoyl)phenyl-acetat [German] [ACD/IUPAC Name]
890099-79-3 [RN]
Acétate de 4-(4-hexylbenzoyl)phényle [French] [ACD/IUPAC Name]
Methanone, [4-(acetyloxy)phenyl](4-hexylphenyl)- [ACD/Index Name]
[4-(4-hexylbenzoyl)phenyl] acetate
4-acetoxy-4-hexylbenzophenone
4-Acetoxy-4'-hexylbenzophenone
MFCD07698969 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 456.8±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.7±3.0 kJ/mol
Flash Point: 198.6±26.8 °C
Index of Refraction: 1.541
Molar Refractivity: 95.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 14645.57
ACD/KOC (pH 5.5): 33373.39
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14645.57
ACD/KOC (pH 7.4): 33373.39
Polar Surface Area: 43 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 304.0±3.0 cm3

Click to predict properties on the Chemicalize site


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