ChemSpider 2D Image | 3-Oxo-2-butanyl 4-[(4-chlorobenzyl)oxy]-3-methoxybenzoate | C19H19ClO5

3-Oxo-2-butanyl 4-[(4-chlorobenzyl)oxy]-3-methoxybenzoate

  • Molecular FormulaC19H19ClO5
  • Average mass362.804 Da
  • Monoisotopic mass362.092102 Da
  • ChemSpider ID22360568

More details:

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

3-Oxo-2-butanyl 4-[(4-chlorobenzyl)oxy]-3-methoxybenzoate [ACD/IUPAC Name]
3-Oxo-2-butanyl-4-[(4-chlorbenzyl)oxy]-3-methoxybenzoat [German] [ACD/IUPAC Name]
4-[(4-Chlorobenzyl)oxy]-3-méthoxybenzoate de 3-oxo-2-butanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(4-chlorophenyl)methoxy]-3-methoxy-, 1-methyl-2-oxopropyl ester [ACD/Index Name]
3-OXOBUTAN-2-YL 4-[(4-CHLOROPHENYL)METHOXY]-3-METHOXYBENZOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 511.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 189.6±29.1 °C
Index of Refraction: 1.555
Molar Refractivity: 94.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 670.54
ACD/KOC (pH 5.5): 3670.76
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 670.54
ACD/KOC (pH 7.4): 3670.76
Polar Surface Area: 62 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 295.0±3.0 cm3

Click to predict properties on the Chemicalize site


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