| Chemical & Physical Properties | |
|---|---|
| CAS Number | 16013-07-3 |
| Catalog No. | 2A-0127391 |
| Chinese Name | 3-(4-溴苯基)-1,2,4-噁二唑 |
| Synonyms | 3-(4-bromophenyl)-1,2,4-oxadiazole |
| Molecular Formula | C8H5BrN2O |
| Molecular Weight | 225.04200 |
| Purity | 96+ |
| Density | 1.605g/cm3 |
| Boiling Point | 303.1ºC at 760mmHg |
| EINECS | 0 |
| HTC | 2934999090 |
| UN(IATA) | 0 |
| PubChem ID | 58138323 |
| SMILES | Brc1ccc(-c2ncon2)cc1 |
| InChI | InChI=1S/C8H5BrN2O/c9-7-3-1-6(2-4-7)8-10-5-12-11-8/h1-5H |
| InChI Key | OOQNOWMRFJKXTC-UHFFFAOYSA-N |
| 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 formula:C8H5BrN2O Molecular weight:225.0 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 bromide. 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. (3-(4-Bromophenyl)-1,2,4-oxadiazole) 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 Xi: Irritant; HS Code 2934999090 Synthetic Route Total: 1 Page 4-Bromo-N-hydro... CAS#:19227-14-6 Triethyl orthof... CAS#:122-51-0 3-(4-Bromopheny... CAS#:16013-07-3 Literature: Journal of Medicinal Chemistry, , vol. 10, p. 208 - 211 Precursor & DownStream Precursor 2 CAS#:19227-14-6 4-Bromo-N-hydro... CAS#:122-51-0 Triethyl orthof... DownStream 0 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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