ChemSpider 2D Image | (1R)-3-Oxocyclohexanecarboxylic acid | C7H10O3

(1R)-3-Oxocyclohexanecarboxylic acid

  • Molecular FormulaC7H10O3
  • Average mass142.152 Da
  • Monoisotopic mass142.062988 Da
  • ChemSpider ID25057076

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-3-Oxocyclohexancarbonsäure [German] [ACD/IUPAC Name]
(1R)-3-Oxocyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide (1R)-3-oxocyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 3-oxo-, (1R)- [ACD/Index Name]
(1R)-3-Oxocyclohexane-1-carboxylic acid
(R)-3-Oxocyclohexanecarboxylic acid
21531-43-1 [RN]
3OC
MFCD19228665

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

Density: 1.2±0.1 g/cm3
Boiling Point: 309.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.5±6.0 kJ/mol
Flash Point: 155.3±22.4 °C
Index of Refraction: 1.500
Molar Refractivity: 33.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.38
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.48
ACD/LogD (pH 7.4): -2.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 115.2±3.0 cm3

Click to predict properties on the Chemicalize site


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