ChemSpider 2D Image | Methyl 4-iodo-1-methoxycyclohexanecarboxylate | C9H15IO3

Methyl 4-iodo-1-methoxycyclohexanecarboxylate

  • Molecular FormulaC9H15IO3
  • Average mass298.118 Da
  • Monoisotopic mass298.006592 Da
  • ChemSpider ID103873514

More details:

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

2097133-18-9 [RN]
4-Iodo-1-méthoxycyclohexanecarboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-iodo-1-methoxy-, methyl ester [ACD/Index Name]
Methyl 4-iodo-1-methoxycyclohexanecarboxylate [ACD/IUPAC Name]
Methyl-4-iod-1-methoxycyclohexancarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 287.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.6±3.0 kJ/mol
Flash Point: 127.4±27.3 °C
Index of Refraction: 1.526
Molar Refractivity: 58.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.32
ACD/KOC (pH 5.5): 499.39
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.32
ACD/KOC (pH 7.4): 499.39
Polar Surface Area: 36 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 40.0±5.0 dyne/cm
Molar Volume: 189.6±5.0 cm3

Click to predict properties on the Chemicalize site


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