Chemical Properties of Methyl .alpha.,.beta.-isopropylidene-d-glycerate (CAS 52373-72-5)

Methyl .alpha.,.beta.-isopropylidene-d-glycerate

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InChI
InChI=1S/C7H12O4/c1-7(2)10-4-5(11-7)6(8)9-3/h5H,4H2,1-3H3
InChI Key
DOWWCCDWPKGNGX-UHFFFAOYSA-N
Formula
C7H12O4
SMILES
COC(=O)C1COC(C)(C)O1
Molecular Weight1
160.17
CAS
52373-72-5
Other Names
  • (R)-2,2-Dimethyl-(1,3)-dioxolane-4-carboxylic methyl ester
  • 1,3-Dioxolane-4-carboxylic acid, 2,2-dimethyl-, methyl ester, (4R)-
  • 1,3-Dioxolane-4-carboxylic acid, 2,2-dimethyl-, methyl ester, (R)-
  • Methyl (R)-(+)-2,2-dimethyl-1,3-dioxolane-4-carboxylate
Sources

Physical Properties

Property Value Unit Source
Δf -374.75 kJ/mol Joback Calculated Property
Δfgas -641.23 kJ/mol Joback Calculated Property
Δfus 21.34 kJ/mol Joback Calculated Property
Δvap 48.15 kJ/mol Joback Calculated Property
logPoct/wat 0.31 Crippen Calculated Property
Pc 3585.64 kPa Joback Calculated Property
Tboil 500.60 K Joback Calculated Property
Tc 713.50 K Joback Calculated Property
Tfus 324.51 K Joback Calculated Property
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 280.60 J/mol×K 500.6 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-O- (ring) 2
-CH3 3
>C< (ring) 1
>C=O (nonring) 1
>CH- (ring) 1
-CH2- (ring) 1

Similar Compounds

Methyl (4s,5r)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate. 1,3-Dioxolane, 2,2-dimethyl-4-(tert-butyloxymethyl)-. Acetone D-glyceraldehyde. Propanoic acid, 2-(1-ethoxyethoxy)-, ethyl ester. Ethyl 2,3-diethoxypropanoate. Methyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-(ethoxycarbonyloxy)acetate. (R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol. 1,3-Dioxolane-4-methanol, 2,2-dimethyl-, (S)-. 1,3-Dioxolane-4-methanol, 2,2-dimethyl-. Tartronic acid, diethyl ester, acetate. 1-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2-methoxy-2-oxoethyl (E)-2-methylbut-2-enoate. D-Erythronic acid .gamma.-lactone, diacetate. Ethyl 2,2-diethoxypropionate. Promoxolane. Diethylmalonic acid, di(2-(3,3-dimethyl-2,4-oxacyclopentyl)ethyl) ester.

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