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| | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid Basic information |
| Product Name: | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid | | Synonyms: | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid;Ribociclib Intermediate 1;7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, 2-chloro-7-cyclopentyl-;2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxy...;2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d];Ribociclib Impurity 53 | | CAS: | 1211443-58-1 | | MF: | C12H12ClN3O2 | | MW: | 265.7 | | EINECS: | 1592732-453-0 | | Product Categories: | | | Mol File: | 1211443-58-1.mol | ![2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid Structure](CAS/20150408/GIF/1211443-58-1.gif) |
| | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid Chemical Properties |
| density | 1.61±0.1 g/cm3(Predicted) | | storage temp. | under inert gas (nitrogen or Argon) at 2-8°C | | pka | 3.63±0.30(Predicted) | | Appearance | White to light yellow Solid | | InChI | InChI=1S/C12H12ClN3O2/c13-12-14-6-7-5-9(11(17)18)16(10(7)15-12)8-3-1-2-4-8/h5-6,8H,1-4H2,(H,17,18) | | InChIKey | LXCZVGKSFJMLRO-UHFFFAOYSA-N | | SMILES | C1(Cl)=NC=C2C=C(C(O)=O)N(C3CCCC3)C2=N1 |
| | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid Usage And Synthesis |
| Uses | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid can be used as an intermediate in organic and pharmaceutical synthesis. | | Synthesis | 2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxaldehyde (2.69 g, 11 mmol) was used as starting material and dissolved in DMF. Subsequently, Oxone (7.2 g, 12 mmol) was added to this solution and the reaction was stirred at room temperature for 6 hours. After completion of the reaction, water was added to the reaction mixture to precipitate the target product. The yellow solid, 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid (2.69 g, 85% yield) was collected by filtration. Mass spectrum (ESI) m/z 266 [M + H]+. | | References | [1] Patent: WO2010/20675, 2010, A1. Location in patent: Page/Page column 91 |
| | 2-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid Preparation Products And Raw materials |
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