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ChemSpider 2D Image | Methyl (~2~H_11_)cyclohexanecarboxylate | C8H3D11O2

Methyl (2H11)cyclohexanecarboxylate

  • Molecular FormulaC8H3D11O2
  • Average mass153.263 Da
  • Monoisotopic mass153.168427 Da
  • ChemSpider ID48058843
  • Non-standard isotope - Non-standard isotope


More details:






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

(2H11)Cyclohexanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclohexane-d11-carboxylic acid, methyl ester [ACD/Index Name]
Methyl (2H11)cyclohexanecarboxylate [ACD/IUPAC Name]
Methyl-(2H11)cyclohexancarboxylat [German] [ACD/IUPAC Name]
1215077-49-8 [RN]
cyclohexanecarboxylic acid methyl ester-d11
methyl 1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexane-1-carboxylate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 183.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.9±3.0 kJ/mol
Flash Point: 60.0±0.0 °C
Index of Refraction: 1.449
Molar Refractivity: 38.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 61.72
ACD/KOC (pH 5.5): 665.60
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 61.72
ACD/KOC (pH 7.4): 665.60
Polar Surface Area: 26 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 32.6±3.0 dyne/cm
Molar Volume: 144.1±3.0 cm3

Click to predict properties on the Chemicalize site






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