(-)-Diacetone-2-keto-L-gulonic acid monohydrate
4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid
Also Known As: Dikegulac|Diprogulic Acid|Dikegulac acid|(-)-Diacetone-2-keto-L-gulonic acid monohydrate|4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid|2,2,5,5-tetramethyltetrahydro-8ah-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxine-8a-carboxylic acid(non-preferred name)|.alpha.-L-xylo-2-Hexulofuranosonic acid, 2,3:4,6-bis-O-(1-methylethylidene)-|2,2,5,5-Tetramethyl-tetrahydro-1,3,4,6,8-pentaoxa-cyclopenta[a]indene-8a-carboxylic acid|(1R,2S,6R,8S)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid|2,2,7,7-tetramethyl-4a,5,8a,8b-tetrahydro-[1,3]dioxolo[[?]:[?]]furo[[?]][1,3]dioxine-3a-carboxylic acid|6,6,11,11-Tetramethyl-2,5,7,10,12-pentaoxatricyclo[7.3.0.03,8]dodecane-1-carboxylic acid
| Molecular Formula | C12H18O7 |
|---|---|
| Molecular Weight | 274.10526 g/mol |
| LogP | 0.47 |
| Topological Polar Surface Area | 83.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.10526 |
| Heavy Atoms | 19 |
| Complexity | 418.3 |
Chemical Identifiers
| CAS Number | 68539-16-2 |
|---|---|
| SMILES | CC1(OCC2C(O1)C3C(O2)(OC(O3)(C)C)C(=O)O)C |
Product Overview
(-)-Diacetone-2-keto-L-gulonic acid monohydrate (CAS 68539-16-2), with molecular formula C12H18O7 and molecular weight 274.10526 g/mol. IUPAC: 4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid.
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