ChemSpider 2D Image | 3-Chloro-5'-fluoro-2,3'-biphenyldicarboxylic acid | C14H8ClFO4

3-Chloro-5'-fluoro-2,3'-biphenyldicarboxylic acid

  • Molecular FormulaC14H8ClFO4
  • Average mass294.662 Da
  • Monoisotopic mass294.009521 Da
  • ChemSpider ID26523056

More details:






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

[1,1'-Biphenyl]-2,3'-dicarboxylic acid, 3-chloro-5'-fluoro- [ACD/Index Name]
3-Chlor-5'-fluor-2,3'-biphenyldicarbonsäure [German] [ACD/IUPAC Name]
3-Chloro-5'-fluoro-2,3'-biphenyldicarboxylic acid [ACD/IUPAC Name]
Acide 3-chloro-5'-fluoro-2,3'-biphényldicarboxylique [French] [ACD/IUPAC Name]
1261937-85-2 [RN]
2-(3-Carboxy-5-fluorophenyl)-6-chlorobenzoic acid
3-Chloro-5'-fluoro[1,1'-biphenyl]-2,3'-dicarboxylic acid
3-Chloro-5'-fluoro-[1,1'-biphenyl]-2,3'-dicarboxylic acid
YB-1736

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

Density: 1.5±0.1 g/cm3
Boiling Point: 484.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 247.0±28.7 °C
Index of Refraction: 1.629
Molar Refractivity: 69.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 195.9±3.0 cm3

Click to predict properties on the Chemicalize site






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