ChemSpider 2D Image | Ethyl 6-(iodomethyl)tetrahydro-2H-pyran-2-carboxylate | C9H15IO3

Ethyl 6-(iodomethyl)tetrahydro-2H-pyran-2-carboxylate

  • Molecular FormulaC9H15IO3
  • Average mass298.118 Da
  • Monoisotopic mass298.006592 Da
  • ChemSpider ID76579884

More details:

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

2H-Pyran-2-carboxylic acid, tetrahydro-6-(iodomethyl)-, ethyl ester [ACD/Index Name]
6-(Iodométhyl)tétrahydro-2H-pyrane-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-(iodomethyl)tetrahydro-2H-pyran-2-carboxylate [ACD/IUPAC Name]
Ethyl-6-(iodmethyl)tetrahydro-2H-pyran-2-carboxylat [German] [ACD/IUPAC Name]
214841-01-7 [RN]
rac-ethyl (2R,6R)-6-(iodomethyl)oxane-2-carboxylate, trans

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

Density: 1.6±0.1 g/cm3
Boiling Point: 306.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 139.4±22.3 °C
Index of Refraction: 1.517
Molar Refractivity: 57.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.81
ACD/KOC (pH 5.5): 587.21
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.81
ACD/KOC (pH 7.4): 587.21
Polar Surface Area: 36 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 191.5±3.0 cm3

Click to predict properties on the Chemicalize site


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