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Predicted properties of the compound entered.

ID AAISAHPFGMWGKQ-XRRVDJEJSA-N
Formula C13H22O3
IUPAC Name (2S,3S,4S)-2,3-dimethyl-4-[(2R)-oxan-2-yloxy]cyclohexan-1-one
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C13H22O3/c1-9-10(2)12(7-6-11(9)14)16-13-5-3-4-8-15-13/h9-10,12-13H,3-8H2,1-2H3/t9-,10-,12-,13+/m0/s1
Standard InChIKey (User Input) InChIKey=AAISAHPFGMWGKQ-XRRVDJEJSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -