ChemSpider 2D Image | (11,11,11-~2~H_3_)Undecanoic acid | C11H19D3O2

(11,11,11-2H3)Undecanoic acid

  • Molecular FormulaC11H19D3O2
  • Average mass189.310 Da
  • Monoisotopic mass189.180817 Da
  • ChemSpider ID24533323
  • Non-standard isotope - Non-standard isotope


More details:






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

(11,11,11-2H3)Undecanoic acid [ACD/IUPAC Name]
(11,11,11-2H3)Undecansäure [German] [ACD/IUPAC Name]
Acide (11,11,11-2H3)undécanoïque [French] [ACD/IUPAC Name]
Undecanoic-11,11,11-d3 acid [ACD/Index Name]
1219802-11-5 [RN]
1-Decanecarboxylic acid
Undecylic acid [Wiki]

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

. [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 283.3±3.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.2±3.0 kJ/mol
Flash Point: 128.2±11.9 °C
Index of Refraction: 1.446
Molar Refractivity: 54.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 193.89
ACD/KOC (pH 5.5): 900.68
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 3.12
ACD/KOC (pH 7.4): 14.47
Polar Surface Area: 37 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 204.7±3.0 cm3

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