ChemSpider 2D Image | [1,1′-Biphenyl]-4-carboxylic acid, 3,4′-difluoro-3′-hydroxy- | C13H8F2O3

[1,1′-Biphenyl]-4-carboxylic acid, 3,4′-difluoro-3′-hydroxy-

  • Molecular FormulaC13H8F2O3
  • Average mass250.198 Da
  • Monoisotopic mass250.044144 Da
  • ChemSpider ID26539290

More details:






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

[1,1′-Biphenyl]-4-carboxylic acid, 3,4′-difluoro-3′-hydroxy-
1261981-87-6 [RN]
[1,1'-Biphenyl]-4-carboxylic acid, 3,4'-difluoro-3'-hydroxy- [ACD/Index Name]
3,4'-Difluor-3'-hydroxy-4-biphenylcarbonsäure [German] [ACD/IUPAC Name]
3,4'-Difluoro-3'-hydroxy[1,1'-biphenyl]-4-carboxylic acid
3,4'-Difluoro-3'-hydroxy-[1,1'-biphenyl]-4-carboxylic acid
3,4'-Difluoro-3'-hydroxy-4-biphenylcarboxylic acid [ACD/IUPAC Name]
5-(4-Carboxy-3-fluorophenyl)-2-fluorophenol
Acide 3,4'-difluoro-3'-hydroxy-4-biphénylcarboxylique [French] [ACD/IUPAC Name]
YA-2802

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

Density: 1.4±0.1 g/cm3
Boiling Point: 420.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 208.3±28.7 °C
Index of Refraction: 1.601
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.32
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 174.1±3.0 cm3

Click to predict properties on the Chemicalize site






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