ChemSpider 2D Image | β-methyliodophenylpentadecanoic acid | C22H35IO2

β-methyliodophenylpentadecanoic acid

  • Molecular FormulaC22H35IO2
  • Average mass458.417 Da
  • Monoisotopic mass458.168152 Da
  • ChemSpider ID24773912

More details:

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

2-Iod-3-methyl-2-phenylpentadecansäure [German] [ACD/IUPAC Name]
2-Iodo-3-methyl-2-phenylpentadecanoic acid [ACD/IUPAC Name]
Acide 2-iodo-3-méthyl-2-phénylpentadécanoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, α-iodo-α-(1-methyltridecyl)- [ACD/Index Name]
β-methyliodophenylpentadecanoic acid
β-methyl iodophenyl pentadecanoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 486.5±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 248.0±26.8 °C
Index of Refraction: 1.536
Molar Refractivity: 114.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 9.71
ACD/LogD (pH 5.5): 6.59
ACD/BCF (pH 5.5): 12475.85
ACD/KOC (pH 5.5): 4640.50
ACD/LogD (pH 7.4): 5.72
ACD/BCF (pH 7.4): 1670.72
ACD/KOC (pH 7.4): 621.44
Polar Surface Area: 37 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 368.0±3.0 cm3

Click to predict properties on the Chemicalize site


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