Found 4 results

Search term: HEMJJKBWTPKOJG (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 5-(2,5-Dimethylphenoxy)-2,2-bis[(~2~H_3_)methyl]pentanoic acid | C15H16D6O3

5-(2,5-Dimethylphenoxy)-2,2-bis[(2H3)methyl]pentanoic acid

  • Molecular FormulaC15H16D6O3
  • Average mass256.370 Da
  • Monoisotopic mass256.194550 Da
  • ChemSpider ID23936204
  • Non-standard isotope - Non-standard isotope


More details:






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

5-(2,5-Dimethylphenoxy)-2,2-bis[(2H3)methyl]pentanoic acid [ACD/IUPAC Name]
5-(2,5-Dimethylphenoxy)-2,2-bis[(2H3)methyl]pentansäure [German] [ACD/IUPAC Name]
Acide 5-(2,5-diméthylphénoxy)-2,2-bis[(2H3)méthyl]pentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 5-(2,5-dimethylphenoxy)-2,2-di(methyl-d3)- [ACD/Index Name]
1184986-45-5 [RN]
2,2-Dimethyl-5-(2,5-dimethylphenoxy)pentanoic acid
GEMFIBROZIL-D6
Gemfibrozil-d6 (2,2-dimethyl-d6)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 394.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 141.6±18.1 °C
Index of Refraction: 1.512
Molar Refractivity: 71.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 137.10
ACD/KOC (pH 5.5): 690.52
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 2.19
ACD/KOC (pH 7.4): 11.03
Polar Surface Area: 47 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 239.7±3.0 cm3

Click to predict properties on the Chemicalize site






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