ChemSpider 2D Image | 9-(~2~H_3_)Methyl-1-(9,10,10,10-~2~H_4_)decanol | C11H17D7O

9-(2H3)Methyl-1-(9,10,10,10-2H4)decanol

  • Molecular FormulaC11H17D7O
  • Average mass179.351 Da
  • Monoisotopic mass179.226654 Da
  • ChemSpider ID48063115

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Decan-9,10,10,10-d4-ol, 9-(methyl-d3)- [ACD/Index Name]
9-(2H3)Methyl-1-(9,10,10,10-2H4)decanol [German] [ACD/IUPAC Name]
9-(2H3)Methyl-1-(9,10,10,10-2H4)decanol [ACD/IUPAC Name]
9-(2H3)Méthyl-1-(9,10,10,10-2H4)décanol [French] [ACD/IUPAC Name]
1794811-01-0 [RN]
9,10,10,10-tetradeuterio-9-(trideuteriomethyl)decan-1-ol

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

Density: 0.8±0.1 g/cm3
Boiling Point: 229.7±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 54.2±6.0 kJ/mol
Flash Point: 94.0±6.5 °C
Index of Refraction: 1.437
Molar Refractivity: 54.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 366.18
ACD/KOC (pH 5.5): 2380.65
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 366.18
ACD/KOC (pH 7.4): 2380.65
Polar Surface Area: 20 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 29.3±3.0 dyne/cm
Molar Volume: 208.0±3.0 cm3

Click to predict properties on the Chemicalize site


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