ChemSpider 2D Image | (3R)-iodofiltic acid | C22H35IO2

(3R)-iodofiltic acid

  • Molecular FormulaC22H35IO2
  • Average mass458.417 Da
  • Monoisotopic mass458.168152 Da
  • ChemSpider ID19374405

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-iodofiltic acid
(3R)-15-(4-Iodophenyl)-3-methylpentadecanoic acid [ACD/IUPAC Name]
(3R)-15-(4-Iodphenyl)-3-methylpentadecansäure [German] [ACD/IUPAC Name]
Acide (3R)-15-(4-iodophényl)-3-méthylpentadécanoïque [French] [ACD/IUPAC Name]
Benzenepentadecanoic acid, 4-iodo-β-methyl-, (βR)- [ACD/Index Name]
iodofiltic 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: 506.1±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.7±3.0 kJ/mol
Flash Point: 259.9±22.6 °C
Index of Refraction: 1.534
Molar Refractivity: 115.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 9.39
ACD/LogD (pH 5.5): 7.53
ACD/BCF (pH 5.5): 200726.05
ACD/KOC (pH 5.5): 130390.60
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 3232.79
ACD/KOC (pH 7.4): 2100.01
Polar Surface Area: 37 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 370.4±3.0 cm3

Click to predict properties on the Chemicalize site


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