| Chemical & Physical Properties | |
|---|---|
| CAS Number | 70-58-6 |
| Catalog No. | 2A-0145076 |
| Chinese Name | 5-氟烟酰胺 |
| Synonyms | 5-fluoropyridine-3-carboxamide |
| Molecular Formula | C6H5O1N2F1 |
| Molecular Weight | 140.12 |
| Purity | 96+ |
| Density | 1.327g/cm3 |
| Boiling Point | 256.7ºC at 760mmHg |
| Storage Condition | room temperature, dry |
| EINECS | 0 |
| HTC | 2933399090 |
| UN(IATA) | 0 |
| MDL Number | MFCD00160352 |
| SMILES | NC(=O)c1cncc(F)c1 |
| InChI | InChI=1S/C6H5FN2O/c7-5-1-4(6(8)10)2-9-3-5/h1-3H,(H2,8,10) |
| InChI Key | GCDSJMZGWCQCRU-UHFFFAOYSA-N |
| MSDS | msds/145076_1_70_58_6.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels. 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 Appearance:Not specified Boiling point:No data Melting point: Flash point:No data Molecular formula:C6H5FN2O Molecular weight:140.1 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 fluoride. 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 Non-harzardous for air and ground transportation. 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 Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Nicotinamide, 5-fluoro- CAS REGISTRY NUMBER : BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C6-H5-F-N2-O MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T6NJ CVZ EF HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CPCHAO Clinical Proceedings of the Children's Hospital of the District of Columbia. (Washington, DC) V.1-27, 1971. For publisher information, see CPNMAQ. Volume(issue)/page/year: 18,307,1962 Safety Information HS Code 2933399090 Synthetic Route Methyl5-fluorop... 3-Pyridinecarbo... Literature: Journal of Organic Chemistry, , vol. 14, p. 328,331 Journal of the Chemical Society, , p. 3512 3-Methylpyridin... 3-Pyridinecarbo... Literature: Journal of Organic Chemistry, , vol. 14, p. 328,331 2-Amino-3-methy... 18344-51-9 3-Pyridinecarbo... Literature: Journal of Organic Chemistry, , vol. 14, p. 328,331 Precursor & DownStream Precursor 10 CAS#:455-70-9 Methyl5-fluorop... CAS#:1603-40-3 3-Methylpyridin... CAS#:18344-51-9 2-Amino-3-methy... CAS#:350-04-9 5-Fluoronicotin... DownStream 0 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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