ChemSpider 2D Image | (4S,4'S)-4,4'-Diisobutyl-1,1'-bis(3-isopropylphenyl)-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole | C32H46N4

(4S,4'S)-4,4'-Diisobutyl-1,1'-bis(3-isopropylphenyl)-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole

  • Molecular FormulaC32H46N4
  • Average mass486.734 Da
  • Monoisotopic mass486.372253 Da
  • ChemSpider ID115006295

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4S,4'S)-4,4'-Diisobutyl-1,1'-bis(3-isopropylphenyl)-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazol [German] [ACD/IUPAC Name]
(4S,4'S)-4,4'-Diisobutyl-1,1'-bis(3-isopropylphenyl)-4,4',5,5'-tetrahydro-1H,1'H-2,2'-biimidazole [ACD/IUPAC Name]
(4S,4'S)-4,4'-Diisobutyl-1,1'-bis(3-isopropylphényl)-4,4',5,5'-tétrahydro-1H,1'H-2,2'-biimidazole [French] [ACD/IUPAC Name]
2,2'-Bi-1H-imidazole, 4,4',5,5'-tetrahydro-1,1'-bis[3-(1-methylethyl)phenyl]-4,4'-bis(2-methylpropyl)-, (4S,4'S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 579.6±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 304.3±30.9 °C
Index of Refraction: 1.581
Molar Refractivity: 152.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 7.30
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 678.32
ACD/KOC (pH 5.5): 868.78
ACD/LogD (pH 7.4): 6.06
ACD/BCF (pH 7.4): 14636.34
ACD/KOC (pH 7.4): 18745.98
Polar Surface Area: 31 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 35.8±7.0 dyne/cm
Molar Volume: 457.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement