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Predicted properties of the compound entered.

ID GFUIDHWFLMPAGY-UHFFFAOYSA-N
Formula C6H12O3
IUPAC Name ethyl 2-hydroxy-2-methylpropanoate
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C6H12O3/c1-4-9-5(7)6(2,3)8/h8H,4H2,1-3H3
Standard InChIKey (User Input) InChIKey=GFUIDHWFLMPAGY-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers Ethyl 2-hydroxy-2-methylpropanoate | ethyl 2-hydroxy-2-methyl-propanoate | 2-hydroxy-2-methylpropanoic acid ethyl ester | 2-hydroxy-2-methyl-propionic acid ethyl ester | 80-55-7 | Propanoic acid, 2-hydroxy-2-methyl-, ethyl ester (9CI) | AIDS-017665 | Ethyl .alpha.-hydroxyisobutyrate | Ethyl 2-hydroxy-2-methylpropionate | Ethyl 2-hydroxyisobutyrate | Ethyl 2-methyllactate | Lactic acid, 2-methyl-, ethyl ester | NSC4667 | Propanoic acid, 2-hydroxy-2-methyl-, ethyl ester | E31200_ALDRICH | ZINC00395638 | AIDS017665 | alpha (or beta) - Hydroxyisobutyric acid, ethyl ester | 2-Methyllactic acid ethyl ester | 4-03-00-00783 (Beilstein Handbook Reference) | AI3-09122 | BRN 0878308 | EINECS 201-290-3 | Ethyl alpha-hydroxyisobutyrate | NSC 4667
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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 - - -
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1H NMR prediction -
13C NMR prediction -
COSY -
HSQC/HMBC prediction -
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