![4-Chloro-7-methyl-7H-pyrrolo[2,3-d]pyrimidine structure, CAS 7781-10-4](/structures/80000/78444_1_7781_10_4.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 7781-10-4 |
| Catalog No. | 2A-9078444 |
| Chinese Name | 4-氯-7-甲基吡咯并[2,3-D]嘧啶 |
| Synonyms | 4-chloro-7-methylpyrrolo[2,3-d]pyrimidine; 4-Chloro-7-methyl-7H-pyrrolo[2,3-d]pyrimidine |
| Molecular Formula | C7H6ClN3 |
| Molecular Weight | 167.60 |
| Purity | 97 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 301.5±22.0 °C at 760 mmHg |
| Appearance | solid |
| Storage Condition | 2-8°C |
| HTC | 2933990090 |
| PubChem ID | 329816125 |
| MDL Number | MFCD00619245 |
| SMILES | Cn1ccc2c(Cl)ncnc12 |
| InChI | 1S/C7H6ClN3/c1-11-3-2-5-6(8)9-4-10-7(5)11/h2-4H,1H3 |
| InChI Key | BJGDLOLPALCTJQ-UHFFFAOYSA-N |
| NACRES Code | NA.21 |
| UNSPSC | 12352200 |
| MSDS | msds/78444_1_7781_10_4.pdf |
| Use of | health and chemical hazard data given on this sheet. Storage:Store in closed vessels, refrigerated. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Not specified Appearance: Boiling point:No data Melting point:No data Flash point:No data Molecular weight:167.6 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen chloride. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Proper shipping name: TOXIC SOLIDS, ORGANIC, N.O.S. (4-Chloro-7-methyl-7h-pyrrolo[2,3-d]pyrimidine) Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information Hazard Codes T Risk Phrases 25 Safety Phrases 45 HS Code 2933990090 Synthetic Route 4-Chloro-7H-pyr... CAS#:3680-69-1 methyl iodide CAS#:74-88-4 4-Chloro-7-meth... CAS#:7781-10-4 methyl iodide CAS#:74-88-4 4-Chloro-7-meth... CAS#:7781-10-4 4-Chloro-7H-pyr... CAS#:3680-69-1 4-Chloro-7-meth... CAS#:7781-10-4 Literature: Journal of Medicinal Chemistry, , vol. 53, # 19 p. 6934 - 6946 Precursor & DownStream Precursor 3 CAS#:3680-69-1 4-Chloro-7H-pyr... CAS#:74-88-4 methyl iodide CAS#:3680-71-5 Pyrrolo[2,3-d]p... DownStream 5 CAS#:1069473-61-5 4-Chloro-7-meth... CAS#:1337532-51-0 5-Bromo-7-Methy... CAS#:1266343-30-9 5-Bromo-4-chlor... CAS#:1337531-36-8 GSK2606414 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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