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Published TCIMAIL newest issue No.197
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CAS RN: 125971-95-1 | Product Number: B3690
tert-Butyl (4R,6R)-2-[6-[2-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxan-4-yl]acetate
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![tert-Butyl (4R,6R)-2-[6-[2-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxan-4-yl]acetate](/_ui/responsive/theme-tci/images/missing_product_zoom.jpg "tert-Butyl (4R,6R)-2-[6-[2-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)pyrrol-1-yl]ethyl]-2,2-dimethyl-1,3-dioxan-4-yl]acetate")
Purity: >98.0%(HPLC)(N)
Synonyms:
- Atorvastatin Acetonide tert-Butyl Ester
Product Documents:
| Size | Unit Price | Belgium | Japan* |
|---|---|---|---|
| 1G |
72,00 €
|
1 | 4 |
| 5G |
231,00 €
|
2 | 4 |
*Stock available in Belgium will be delivered in 1 to 3 days
*Stock available in Japan will be delivered in 1 to 2 weeks (excludes regulated items and dry ice shipments).
| Product Number | B3690 |
| Purity / Analysis Method | >98.0%(HPLC)(N) |
| Molecular Formula / Molecular Weight | C__4__0H__4__7FN__2O__5 = 654.82 |
| Physical State (20 deg.C) | Solid |
| Storage Temperature | Room Temperature (Recommended in a cool and dark place, <15°C) |
| Packaging and Container | 1G-Glass Bottle with Plastic Insert (View image) |
| CAS RN | 125971-95-1 |
| Reaxys Registry Number | 5370240 |
| PubChem Substance ID | 125307955 |
| SDBS (AIST Spectral DB) | 52952 |
| MDL Number | MFCD04039904 |
Specifications
| Appearance | White to Almost white powder to crystal |
| Purity(HPLC) | min. 98.0 area% |
| Purity(with Total Nitrogen) | min. 98.0 % |
| Melting point | 144.0 to 148.0 °C |
| Specific rotation [a]20/D | +5.0 to +8.0 deg(C=1, CHCl3) |
| NMR | confirm to structure |
Properties (reference)
| Melting Point | 146 °C |
| Specific Rotation | 7° (C=1,CHCl3) |
| Solubility (soluble in) | Chloroform |
GHS
Related Laws:
Transport Information:
| HS Number | 2933998090 |
Application
A Key Synthetic Intermediate of Atorvastatin
This product is a key synthetic intermediate of atorvastatin [A2476, Ca salt] which is a potent HMG-CoA ((3-hydroxy-3-methylglutaryl coenzyme A) reductase inhibitor.
References
- Concise synthesis of atorvastatin lactone under high-speed vibration milling conditions
- Total synthesis of atorvastatin via a late-stage, regioselective 1,3-dipolar munchnone cycloaddition
- An improved kilogram-scale preparation of atorvastatin calcium
- Stress degradation behavior of atorvastatin calcium and development of a suitable stability-indicating LC method for the determination of atorvastatin, its related impurities, and its degradation products
Application
Synthesis of atorvastatin calcium
References
- The convergent synthesis of CI-981, an optically active, highly potent, tissue selective inhibitor of HMG-CoA reductase
PubMed Literature
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