ChemSpider 2D Image | 2-Fluoro-4-(4-methyl-2-thienyl)benzoic acid | C12H9FO2S

2-Fluoro-4-(4-methyl-2-thienyl)benzoic acid

  • Molecular FormulaC12H9FO2S
  • Average mass236.262 Da
  • Monoisotopic mass236.030731 Da
  • ChemSpider ID26544965

More details:

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

2-Fluor-4-(4-methyl-2-thienyl)benzoesäure [German] [ACD/IUPAC Name]
2-Fluoro-4-(4-methyl-2-thienyl)benzoic acid [ACD/IUPAC Name]
Acide 2-fluoro-4-(4-méthyl-2-thiényl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-4-(4-methyl-2-thienyl)- [ACD/Index Name]
1261900-00-8 [RN]
1261944-34-6 [RN]
2-Fluoro-4-(4-methylthiophen-2-yl)benzoic acid
2-FLUORO-4-(4-METHYLTHIOPHENYL)BENZOIC ACID

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

Density: 1.3±0.1 g/cm3
Boiling Point: 366.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.7±3.0 kJ/mol
Flash Point: 175.7±27.9 °C
Index of Refraction: 1.604
Molar Refractivity: 61.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 3.73
ACD/KOC (pH 5.5): 21.51
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.53
Polar Surface Area: 66 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 177.2±3.0 cm3

Click to predict properties on the Chemicalize site


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