ChemSpider 2D Image | 3-[2-(trans-4-Methylcyclohexyl)phenyl]-5-phenyl-2-thiophenecarboxylic acid | C24H24O2S

3-[2-(trans-4-Methylcyclohexyl)phenyl]-5-phenyl-2-thiophenecarboxylic acid

  • Molecular FormulaC24H24O2S
  • Average mass376.511 Da
  • Monoisotopic mass376.149689 Da
  • ChemSpider ID25028755

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-Thiophenecarboxylic acid, 3-[2-(trans-4-methylcyclohexyl)phenyl]-5-phenyl- [ACD/Index Name]
3-[2-(trans-4-Methylcyclohexyl)phenyl]-5-phenyl-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
3-[2-(trans-4-Methylcyclohexyl)phenyl]-5-phenyl-2-thiophenecarboxylic acid [ACD/IUPAC Name]
3-[2-(trans-4-methylcyclohexyl)phenyl]-5-phenylthiophene-2-carboxylic acid
Acide 3-[2-(trans-4-méthylcyclohexyl)phényl]-5-phényl-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
HJZ

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

Density: 1.2±0.1 g/cm3
Boiling Point: 501.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 257.1±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 111.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.04
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 2264.14
ACD/KOC (pH 5.5): 2337.90
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 194.61
ACD/KOC (pH 7.4): 200.95
Polar Surface Area: 66 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 323.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement