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Search term: ClC=1C=CC(=NC1C1=CC=CC=C1)C(=O)OC(C)C (Found by conversion of search term to chemical structure (full match))

ChemSpider 2D Image | Isopropyl 5-chloro-6-phenyl-2-pyridinecarboxylate | C15H14ClNO2

Isopropyl 5-chloro-6-phenyl-2-pyridinecarboxylate

  • Molecular FormulaC15H14ClNO2
  • Average mass275.730 Da
  • Monoisotopic mass275.071320 Da
  • ChemSpider ID74790646

More details:






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

2-Pyridinecarboxylic acid, 5-chloro-6-phenyl-, 1-methylethyl ester [ACD/Index Name]
5-Chloro-6-phényl-2-pyridinecarboxylate d'isopropyle [French] [ACD/IUPAC Name]
Isopropyl 5-chloro-6-phenyl-2-pyridinecarboxylate [ACD/IUPAC Name]
Isopropyl-5-chlor-6-phenyl-2-pyridincarboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 387.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 188.4±27.9 °C
Index of Refraction: 1.561
Molar Refractivity: 74.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 293.23
ACD/KOC (pH 5.5): 2030.64
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 293.23
ACD/KOC (pH 7.4): 2030.64
Polar Surface Area: 39 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 231.2±3.0 cm3

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