ChemSpider 2D Image | 4-{1-[3-(2,6-Dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(2-methyl-2-propanyl)-2-pyrrolidinone | C26H33N3O3

4-{1-[3-(2,6-Dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(2-methyl-2-propanyl)-2-pyrrolidinone

  • Molecular FormulaC26H33N3O3
  • Average mass435.559 Da
  • Monoisotopic mass435.252197 Da
  • ChemSpider ID21851589

More details:

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

2-Pyrrolidinone, 1-(1,1-dimethylethyl)-4-[1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl]- [ACD/Index Name]
4-{1-[3-(2,6-Dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(2-methyl-2-propanyl)-2-pyrrolidinon [German] [ACD/IUPAC Name]
4-{1-[3-(2,6-Dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(2-methyl-2-propanyl)-2-pyrrolidinone [ACD/IUPAC Name]
4-{1-[3-(2,6-Diméthylphénoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}-1-(2-méthyl-2-propanyl)-2-pyrrolidinone [French] [ACD/IUPAC Name]
1-(tert-butyl)-4-(1-(3-(2,6-dimethylphenoxy)-2-hydroxypropyl)-1H-benzo[d]imidazol-2-yl)pyrrolidin-2-one
1-(tert-butyl)-4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]benzimidazol-2-yl }pyrrolidin-2-one
1-(tert-butyl)-4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]benzimidazol-2-yl}pyrrolidin-2-one
1018146-37-6 [RN]
1-tert-butyl-4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one
1-tert-butyl-4-{1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1H-benzimidazol-2-yl}pyrrolidin-2-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 666.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 357.0±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 125.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.77
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 683.94
ACD/KOC (pH 5.5): 3506.30
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 842.19
ACD/KOC (pH 7.4): 4317.63
Polar Surface Area: 68 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 365.1±7.0 cm3

Click to predict properties on the Chemicalize site


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