CAS Number425378-68-3
Synonyms2-(2-Fluoro-5-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2-Fluoro-5-nitrophenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
Molecular FormulaC12H15BFNO4
Molecular Weight267.06
Density1.2±0.1 g/cm3
Boiling Point355.3±32.0 °C at 760 mmHg
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 425378-68-3 |
| Catalog No. | 2A-9083921 |
| Chinese Name | 2-(2-氟-5-硝基苯基)-4,4,5,5-四甲基-1,3,2-二氧杂环戊硼烷 |
| Synonyms | 2-(2-Fluoro-5-nitrophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2-Fluoro-5-nitrophenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane |
| Molecular Formula | C12H15BFNO4 |
| Molecular Weight | 267.06 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 355.3±32.0 °C at 760 mmHg |
| Appearance | solid |
| Storage Condition | 2-8°C |
| HTC | 2931900090 |
| PubChem ID | 329826390 |
| MDL Number | MFCD06409955 |
| SMILES | CC1(C)OB(OC1(C)C)c2cc(ccc2F)[N+]([O-])=O |
| InChI | 1S/C12H15BFNO4/c1-11(2)12(3,4)19-13(18-11)9-7-8(15(16)17)5-6-10(9)14/h5-7H,1-4H3 |
| InChI Key | FXEVKZIXXGDLFW-UHFFFAOYSA-N |
| NACRES Code | NA.21 |
| UNSPSC | 12352200 |
| MSDS | msds/83921_1_425378_68_3.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 formula:C12H15BFNO4 Molecular weight:267.1 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 Safety Information Hazard Codes Xi: Irritant; HS Code 2931900090 Synthetic Route Total: 1 Page 3-Bromo-4-fluor... CAS#:701-45-1 Bis(pinacolato)... CAS#:73183-34-3 2-(2-Fluoro-5-n... CAS#:425378-68-3 1-Fluoro-4-nitr... CAS#:350-46-9 2-(2-Fluoro-5-n... CAS#:425378-68-3 Literature: Russell, Michael G. N.; Carling, Robert W.; Street, Leslie J.; Hallett, David J.; Goodacre, Simon; Mezzogori, Elena; Reader, Michael; Cook, Susan M.; Bromidge, Frances A.; Newman, Robert; Smith, Alison J.; Wafford, Keith A.; Marshall, George R.; Reynolds, David S.; Dias, Rebecca; Ferris, Pushpindar; Stanley, Jo; Lincoln, Rachael; Tye, Spencer J.; Sheppard, Wayne F. A.; Sohal, Bindi; Pike, Andrew; Dominguez, Maria; Atack, John R.; Castro, Jose L. Journal of Medicinal Chemistry, 2006 , vol. 49, # 4 p. 1235 - 1238 |
| Tax Rebate | 13.0% |
| Supervision | AB (Inbound cargo customs clearance form) |
| Transport Info | Product name: 2-Fluoro-5-nitrophenylboronic acid pinacol ester |
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