ChemSpider 2D Image | Ethyl 4-[4-(1-pyrrolidinylmethyl)benzoyl]benzoate | C21H23NO3

Ethyl 4-[4-(1-pyrrolidinylmethyl)benzoyl]benzoate

  • Molecular FormulaC21H23NO3
  • Average mass337.412 Da
  • Monoisotopic mass337.167786 Da
  • ChemSpider ID21399057

More details:

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

4-[4-(1-Pyrrolidinylméthyl)benzoyl]benzoate d'éthyle [French] [ACD/IUPAC Name]
898776-17-5 [RN]
Benzoic acid, 4-[4-(1-pyrrolidinylmethyl)benzoyl]-, ethyl ester [ACD/Index Name]
Ethyl 4-[4-(1-pyrrolidinylmethyl)benzoyl]benzoate [ACD/IUPAC Name]
Ethyl 4-{4-[(pyrrolidin-1-yl)methyl]benzoyl}benzoate
Ethyl-4-[4-(1-pyrrolidinylmethyl)benzoyl]benzoat [German] [ACD/IUPAC Name]
4-CARBOETHOXY-4'-PYRROLIDIN-1-YLMETHYLBENZOPHENONE
4-carboethoxy-4'-pyrrolidinomethyl benzophenone
4-carboethoxy-4-pyrrolidinomethyl benzophenone
4-carboethoxy-4'-pyrrolidinomethylbenzophenone
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 478.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 243.4±25.9 °C
Index of Refraction: 1.585
Molar Refractivity: 97.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.34
ACD/LogD (pH 7.4): 2.16
ACD/BCF (pH 7.4): 9.67
ACD/KOC (pH 7.4): 54.78
Polar Surface Area: 47 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 290.6±3.0 cm3

Click to predict properties on the Chemicalize site


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