CAS Number2069-41-2
Synonyms4-Brom-4'-fluor-benzophenon; 4-Bromo-4'-fluorobenzophenone; 4-fluoro-4'-bromo diphenyl ketone
Molecular FormulaC13H8BrFO
Molecular Weight279.10400
Density1.485g/cm3
Boiling Point353.4ºC at 760 mmHg
Melting Point107-108°C (lit.)
AppearanceWhite to off-white to light yellow powder or crystal
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 2069-41-2 |
| Catalog No. | 2A-9062231 |
| Chinese Name | 4-溴-4'-氟苯甲酮 |
| Synonyms | 4-Brom-4'-fluor-benzophenon; 4-Bromo-4'-fluorobenzophenone; 4-fluoro-4'-bromo diphenyl ketone |
| Molecular Formula | C13H8BrFO |
| Molecular Weight | 279.10400 |
| Density | 1.485g/cm3 |
| Boiling Point | 353.4ºC at 760 mmHg |
| Melting Point | 107-108°C (lit.) |
| Appearance | White to off-white to light yellow powder or crystal |
| Storage Condition | room temperature, dry |
| HTC | 2914700090 |
| SMILES | O=C(c1ccc(F)cc1)c1ccc(Br)cc1 |
| InChI | InChI=1S/C13H8BrFO/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H |
| InChI Key | SSXSFTBOKUQUAX-UHFFFAOYSA-N |
| 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:C13H8BrFO 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, hydrogen fluoride, 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 HS Code 2914700090 Synthetic Route Fluorobenzene CAS#:462-06-6 4-Bromobenzoic acid CAS#:586-76-5 4-Bromo-4'-fluo... CAS#:2069-41-2 Fluorobenzene CAS#:462-06-6 4-Bromobenzoyl ... CAS#:586-75-4 4-Bromo-4'-fluo... CAS#:2069-41-2 Literature: Vejdelek; Metys; Holubek; et al. Collection of Czechoslovak Chemical Communications, 1984 , vol. 49, # 11 p. 2649 - 2660 4-Bromobenzyl c... CAS#:589-17-3 4-Bromo-4'-fluo... CAS#:2069-41-2 Literature: The United States of America as represented by the Administrator of the National Aeronautics and Space Administration Patent: US5312994 A1, 1994 ; Precursor & DownStream Precursor 8 CAS#:462-06-6 Fluorobenzene CAS#:586-76-5 4-Bromobenzoic acid CAS#:586-75-4 4-Bromobenzoyl ... CAS#:589-17-3 4-Bromobenzyl c... DownStream 2 CAS#:153354-46-2 (4-fluorophenyl... CAS#:3851-47-6 (4-Bromophenyl)... |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0% |
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