ChemSpider 2D Image | 4-(3-Chlorobenzyl)proline | C12H14ClNO2

4-(3-Chlorobenzyl)proline

  • Molecular FormulaC12H14ClNO2
  • Average mass239.698 Da
  • Monoisotopic mass239.071304 Da
  • ChemSpider ID62038766

More details:

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

4-(3-Chlorbenzyl)prolin [German] [ACD/IUPAC Name]
4-(3-Chlorobenzyl)proline [ACD/IUPAC Name]
4-(3-Chlorobenzyl)proline [French] [ACD/IUPAC Name]
Proline, 4-[(3-chlorophenyl)methyl]- [ACD/Index Name]
1780622-27-6 [RN]
MFCD28053754 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 405.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 199.1±27.3 °C
Index of Refraction: 1.576
Molar Refractivity: 62.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.17
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.17
Polar Surface Area: 49 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 187.3±3.0 cm3

Click to predict properties on the Chemicalize site


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