ChemSpider 2D Image | Cyclohexanecarboxylic-1-d1 Acid | C7H11DO2

Cyclohexanecarboxylic-1-d1 Acid

  • Molecular FormulaC7H11DO2
  • Average mass129.175 Da
  • Monoisotopic mass129.090012 Da
  • ChemSpider ID24532362

  • Non-standard isotope - Non-standard isotope

More details:

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

(1-2H)Cyclohexancarbonsäure [German] [ACD/IUPAC Name]
(1-2H)Cyclohexanecarboxylic acid [ACD/IUPAC Name]
933-37-9 [RN]
Acide (1-2H)cyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexane-1-d-carboxylic acid [ACD/Index Name]
Cyclohexanecarboxylic-1-d1 Acid
Cyclohexanoic acid
Hexahydrobenzoic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 233.0±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 51.7±6.0 kJ/mol
Flash Point: 107.0±13.1 °C
Index of Refraction: 1.481
Molar Refractivity: 33.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 3.89
ACD/KOC (pH 5.5): 58.78
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 118.7±3.0 cm3

Click to predict properties on the Chemicalize site


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