ChemSpider 2D Image | Methyl 4-[(3-chlorobenzyl)oxy]-3-methylbenzoate | C16H15ClO3

Methyl 4-[(3-chlorobenzyl)oxy]-3-methylbenzoate

  • Molecular FormulaC16H15ClO3
  • Average mass290.741 Da
  • Monoisotopic mass290.070984 Da
  • ChemSpider ID24698596

More details:

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

4-[(3-Chlorobenzyl)oxy]-3-méthylbenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(3-chlorophenyl)methoxy]-3-methyl-, methyl ester [ACD/Index Name]
Methyl 4-[(3-chlorobenzyl)oxy]-3-methylbenzoate [ACD/IUPAC Name]
Methyl-4-[(3-chlorbenzyl)oxy]-3-methylbenzoat [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL480636/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 414.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.7±3.0 kJ/mol
Flash Point: 161.3±24.9 °C
Index of Refraction: 1.571
Molar Refractivity: 78.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1692.84
ACD/KOC (pH 5.5): 7122.65
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 1692.84
ACD/KOC (pH 7.4): 7122.65
Polar Surface Area: 36 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 240.3±3.0 cm3

Click to predict properties on the Chemicalize site


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