ChemSpider 2D Image | 4-Butoxyphenyl 4-pentylbenzoate | C22H28O3

4-Butoxyphenyl 4-pentylbenzoate

  • Molecular FormulaC22H28O3
  • Average mass340.456 Da
  • Monoisotopic mass340.203857 Da
  • ChemSpider ID24589968

More details:






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

4-Butoxyphenyl 4-pentylbenzoate [ACD/IUPAC Name]
4-Butoxyphenyl-4-pentylbenzoat [German] [ACD/IUPAC Name]
4-Pentylbenzoate de 4-butoxyphényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-pentyl-, 4-butoxyphenyl ester [ACD/Index Name]
(4-butoxyphenyl) 4-pentylbenzoate
[51128-24-6]
4-butoxyphenyl4-pentylbenzoate
4-n-Pentylbenzoic acid 4'-n-butoxyphenyl ester
4-N-PENTYLBENZOICACID4-N-BUTOXYPHENYLESTER
51128-24-6 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 467.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 200.9±21.4 °C
Index of Refraction: 1.532
Molar Refractivity: 101.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 7.21
ACD/BCF (pH 5.5): 177170.20
ACD/KOC (pH 5.5): 198780.69
ACD/LogD (pH 7.4): 7.21
ACD/BCF (pH 7.4): 177170.20
ACD/KOC (pH 7.4): 198780.69
Polar Surface Area: 36 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 38.1±3.0 dyne/cm
Molar Volume: 328.7±3.0 cm3

Click to predict properties on the Chemicalize site






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