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| | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione Basic information |
| Product Name: | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione | | Synonyms: | CHEMPACIFIC 41980;CYCL-ISOPROPYLIDENE METHYLMALONATE;METHYLMALONIC ACID CYCLIC ISOPROPYLIDENE ESTER;METHYL MELDRUM'S ACID;2,2,5-TRIMETHYL-1,3-DIOXANE-4,6-DIONE;1,3-DIOXANE-4,6-DIONE, 2,2,5-TRIMETHYL;2-METHYLCYCLOPROPANECARBOXYLIC ACID, 98% , MIXTURE OF CIS AND TRANS;2,2,5-Trimethyl-1,3-Dioxane-4,6-Dione 98% | | CAS: | 3709-18-0 | | MF: | C7H10O4 | | MW: | 158.15 | | EINECS: | 223-050-7 | | Product Categories: | | | Mol File: | 3709-18-0.mol |  |
| | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione Chemical Properties |
| Melting point | 111-114 °C(lit.) | | Boiling point | 203.22°C (rough estimate) | | density | 1.1229 (rough estimate) | | refractive index | 1.4610 (estimate) | | storage temp. | Inert atmosphere,Room Temperature | | solubility | Chloroform, Methanol | | form | Solid | | pka | 13.14±0.40(Predicted) | | color | White to Off-White | | BRN | 124044 | | InChI | 1S/C7H10O4/c1-4-5(8)10-7(2,3)11-6(4)9/h4H,1-3H3 | | InChIKey | KJMCAXYHYPDRAV-UHFFFAOYSA-N | | SMILES | CC1C(=O)OC(C)(C)OC1=O | | CAS DataBase Reference | 3709-18-0(CAS DataBase Reference) |
| Safety Statements | 23-24/25 | | WGK Germany | 3 | | F | 10-21 | | HS Code | 29171990 | | Storage Class | 11 - Combustible Solids |
| | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione Usage And Synthesis |
| Chemical Properties | White to slightly pink crystalline powder | | Uses | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione is used as a reagent in the synthesis of 3'',4''-bis-difluoromethoxycinnamoylanthranilate (FT061) which is an orally-active antifibrotic agent that reduces albuminuria in rat models of progressive diabetic nephropathy. | | Uses | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione was used for trapping the adduct formed during the reaction between alkyl isocyanides and dialkyl acetylenedicarboxylates. | | General Description | X-ray irradiated single crystals of 2,2,5-trimethyl-1,3-dioxane-4,6-dione have been investigated by electron spin resonance (ESR), electron nuclear double resonance (ENDOR) and electron-electron double resonance (ELDOR) spectra. |
| | 2,2,5-Trimethyl-1,3-dioxane-4,6-dione Preparation Products And Raw materials |
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