ChemSpider 2D Image | 2-Chloro-5-(4-fluoro-3-methoxyphenyl)isonicotinic acid | C13H9ClFNO3

2-Chloro-5-(4-fluoro-3-methoxyphenyl)isonicotinic acid

  • Molecular FormulaC13H9ClFNO3
  • Average mass281.667 Da
  • Monoisotopic mass281.025513 Da
  • ChemSpider ID26522092

More details:

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

2-Chlor-5-(4-fluor-3-methoxyphenyl)isonicotinsäure [German] [ACD/IUPAC Name]
2-Chloro-5-(4-fluoro-3-methoxyphenyl)isonicotinic acid [ACD/IUPAC Name]
4-Pyridinecarboxylic acid, 2-chloro-5-(4-fluoro-3-methoxyphenyl)- [ACD/Index Name]
Acide 2-chloro-5-(4-fluoro-3-méthoxyphényl)isonicotinique [French] [ACD/IUPAC Name]
1261903-77-8 [RN]
2-Chloro-5-(4-fluoro-3-methoxyphenyl)pyridine-4-carboxylic acid
95%
YA-7161

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

Density: 1.4±0.1 g/cm3
Boiling Point: 473.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 240.2±27.3 °C
Index of Refraction: 1.587
Molar Refractivity: 67.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): -0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.32
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 200.6±3.0 cm3

Click to predict properties on the Chemicalize site


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