| Chemical & Physical Properties | |
|---|---|
| CAS Number | 101184-73-0 |
| Catalog No. | 2A-9049801 |
| Chinese Name | 2-(4-溴苯基)-2-甲基丙腈 |
| Synonyms | MFCD02684219; 2-(4-Bromophenyl)-2-methylpropanenitrile |
| Molecular Formula | C10H10BrN |
| Molecular Weight | 224.1 |
| Purity | 98.00 |
| Density | 1.352g/cm3 |
| Boiling Point | 299.8ºC at 760mmHg |
| Melting Point | 110-113ºC |
| Appearance | Colorless to light yellow transparent liquid |
| Storage Condition | Keep Cold |
| HTC | 2926909090 |
| PubChem ID | 15464146 |
| SMILES | CC(C)(C#N)c1ccc(Br)cc1 |
| InChI | InChI=1S/C10H10BrN/c1-10(2,7-12)8-3-5-9(11)6-4-8/h3-6H,1-2H3 |
| InChI Key | DABJLFKRJWUXMV-UHFFFAOYSA-N |
| Use of | health and chemical hazard data given on this sheet. Storage: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: Melting point:No data Flash point:No data Molecular formula:C10H10BrN Molecular weight:224.1 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 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 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 Safety Information Hazard Codes Xi: Irritant; Risk Phrases 22-51 HS Code 2926909090 Synthetic Route Total: 1 Page 4-Bromobenzyl c... CAS#:16532-79-9 methyl iodide CAS#:74-88-4 2-(4-Bromopheny... CAS#:101184-73-0 Literature: Fotsch, Christopher; Bartberger, Michael D.; Bercot, Eric A.; Chen, Michelle; Cupples, Rod; Emery, Maury; Fretland, Jenne; Guram, Anil; Hale, Clarence; Han, Nianhe; Hickman, Dean; Hungate, Randall W.; Hayashi, Michael; Komorowski, Renee; Liu, Qingyian; Matsumoto, Guy; St. Jean Jr., David J.; Ursu, Stefania; Veniant, Murielle; Xu, Guifen; Ye, Qiuping; Yuan, Chester; Zhang, Jiandong; Zhang, Xiping; Tu, Hua; Wang, Minghan Journal of Medicinal Chemistry, 2008 , vol. 51, # 24 p. 7953 - 7967 methyl iodide CAS#:74-88-4 2-(4-Bromopheny... CAS#:101184-73-0 Literature: Ube Industries, Ltd.; SANTEN PHARMACEUTICAL CO., LTD. Patent: EP1679308 A1, 2006 ; Location in patent: Page/Page column 29 ; EP 1679308 A1 4-Bromobenzyl c... CAS#:16532-79-9 2-(4-Bromopheny... CAS#:101184-73-0 Literature: US6358974 B1, ; Precursor & DownStream Precursor 2 CAS#:16532-79-9 4-Bromobenzyl c... CAS#:74-88-4 methyl iodide DownStream 5 CAS#:32454-35-6 2-(4-Bromopheny... CAS#:850568-67-1 [4-(2-Cyano-2-p... CAS#:83799-24-0 Fexofenadine CAS#:850144-81-9 2-(4-BROMOPHENY... |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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