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Search term: CIFSKZDQGRCLBN (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (3R)-3-Methylcyclohexanecarboxylic acid | C8H14O2

(3R)-3-Methylcyclohexanecarboxylic acid

  • Molecular FormulaC8H14O2
  • Average mass142.196 Da
  • Monoisotopic mass142.099380 Da
  • ChemSpider ID32990839
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

(3R)-3-Methylcyclohexancarbonsäure [German] [ACD/IUPAC Name]
(3R)-3-Methylcyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide (3R)-3-méthylcyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 3-methyl-, (3R)- [ACD/Index Name]
1315057-46-5 [RN]
MFCD19228477

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

Density: 1.0±0.1 g/cm3
Boiling Point: 235.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 52.1±6.0 kJ/mol
Flash Point: 110.7±13.1 °C
Index of Refraction: 1.467
Molar Refractivity: 38.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 8.57
ACD/KOC (pH 5.5): 111.43
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.98
Polar Surface Area: 37 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 138.7±3.0 cm3

Click to predict properties on the Chemicalize site






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