ChemSpider 2D Image | [1,1′-Biphenyl]-2-carboxylic acid, 3′,5-difluoro-4′-hydroxy- | C13H8F2O3

[1,1′-Biphenyl]-2-carboxylic acid, 3′,5-difluoro-4′-hydroxy-

  • Molecular FormulaC13H8F2O3
  • Average mass250.198 Da
  • Monoisotopic mass250.044144 Da
  • ChemSpider ID26536161

More details:






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

[1,1′-Biphenyl]-2-carboxylic acid, 3′,5-difluoro-4′-hydroxy-
1261927-02-9 [RN]
[1,1'-Biphenyl]-2-carboxylic acid, 3',5-difluoro-4'-hydroxy- [ACD/Index Name]
3',5-Difluor-4'-hydroxy-2-biphenylcarbonsäure [German] [ACD/IUPAC Name]
3',5-Difluoro-4'-hydroxy[1,1'-biphenyl]-2-carboxylic acid
3',5-Difluoro-4'-hydroxy-[1,1'-biphenyl]-2-carboxylic acid
3',5-Difluoro-4'-hydroxy-2-biphenylcarboxylic acid [ACD/IUPAC Name]
4-Fluoro-2-(3-fluoro-4-hydroxyphenyl)benzoic acid
Acide 3',5-difluoro-4'-hydroxy-2-biphénylcarboxylique [French] [ACD/IUPAC Name]
YA-9796

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

Density: 1.4±0.1 g/cm3
Boiling Point: 375.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 180.9±26.5 °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: 2.57
ACD/LogD (pH 5.5): 0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.73
ACD/LogD (pH 7.4): -0.53
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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