CAS Number352359-23-0
Synonyms1H-Indole-1-carboxylic acid, 2-borono-5-fluoro-, 1,1-dimethylethyl ester; (5-Fluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid; 1-Boc-5-Fluoro-1H-indole-2-boronic acid; MFCD04114581; [5-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid; [1-(tert-Butoxycarbonyl)-5-fluoro-1H-indol-2-yl]boronic acid; (1-(tert-Butoxycarbonyl)-5-fluoro-1H-indol-2-yl)boronic acid
Molecular FormulaC13H15BFNO4
Molecular Weight279.072
Purity98.00%
Density1.2±0.1 g/cm3
Boiling Point446.5±55.0 °C at 760 mmHg
Melting Point130-140ºC
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 352359-23-0 |
| Catalog No. | 2A-9056773 |
| Chinese Name | N-叔丁氧羰基-5-氟吲哚-2-硼酸 |
| Synonyms | 1H-Indole-1-carboxylic acid, 2-borono-5-fluoro-, 1,1-dimethylethyl ester; (5-Fluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-1H-indol-2-yl)boronic acid; 1-Boc-5-Fluoro-1H-indole-2-boronic acid; MFCD04114581; [5-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid; [1-(tert-Butoxycarbonyl)-5-fluoro-1H-indol-2-yl]boronic acid; (1-(tert-Butoxycarbonyl)-5-fluoro-1H-indol-2-yl)boronic acid |
| Molecular Formula | C13H15BFNO4 |
| Molecular Weight | 279.072 |
| Purity | 98.00 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 446.5±55.0 °C at 760 mmHg |
| Melting Point | 130-140ºC |
| Storage Condition | Keep Cold |
| HTC | 2933990090 |
| SMILES | CC(C)(C)OC(=O)n1c(B(O)O)cc2cc(F)ccc21 |
| InChI Key | TZHYEXHDCFQZGG-UHFFFAOYSA-N |
| MSDS | msds/56773_1_352359_23_0.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels, under −20◦C. 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:C13H15BFNO4 Molecular weight:279.1 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 2933990090 Synthetic Route Total: 1 Page 1-(tert-Butoxyc... CAS#:129822-47-5 1-Boc-5-fluoroi... CAS#:352359-23-0 Literature: Mizuta, Masahiro; Seio, Kohji; Miyata, Kenichi; Sekine, Mitsuo Journal of Organic Chemistry, 2007 , vol. 72, # 14 p. 5046 - 5055 5-Fluoroindole CAS#:399-52-0 1-Boc-5-fluoroi... CAS#:352359-23-0 Literature: Journal of Organic Chemistry, , vol. 72, # 14 p. 5046 - 5055 Di-tert-butyl d... CAS#:24424-99-5 1-Boc-5-fluoroi... CAS#:352359-23-0 Literature: Journal of Organic Chemistry, , vol. 72, # 14 p. 5046 - 5055 Precursor & DownStream Precursor 3 CAS#:129822-47-5 1-(tert-Butoxyc... CAS#:399-52-0 5-Fluoroindole CAS#:24424-99-5 Di-tert-butyl d... DownStream 0 |
| 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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