CAS Number72517-23-8
Synonyms5-Brom-2,3-dimethoxy-benzoesaeure; 5-bromo-2,3-dimethoxy-benzoic acid; 2,3-Dimethoxy-5-brombenzoesaeure; 2,3-Dimethoxy-5-bromobenzoic acid
Molecular FormulaC9H9O4Br1
Molecular Weight261.07
Purity96+%
Density1.571g/cm3
Boiling Point348.1ºC at 760mmHg
EINECS0
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 72517-23-8 |
| Catalog No. | 2A-0143110 |
| Chinese Name | 5-溴-2,3-二甲氧基苯甲酸 |
| Synonyms | 5-Brom-2,3-dimethoxy-benzoesaeure; 5-bromo-2,3-dimethoxy-benzoic acid; 2,3-Dimethoxy-5-brombenzoesaeure; 2,3-Dimethoxy-5-bromobenzoic acid |
| Molecular Formula | C9H9O4Br1 |
| Molecular Weight | 261.07 |
| Purity | 96+ |
| Density | 1.571g/cm3 |
| Boiling Point | 348.1ºC at 760mmHg |
| Storage Condition | Room temperature, protected from light, dry and se |
| EINECS | 0 |
| HTC | 2918990090 |
| UN(IATA) | 0 |
| MDL Number | MFCD01321078 |
| SMILES | COc1cc(Br)cc(C(=O)O)c1OC |
| InChI | InChI=1S/C9H9BrO4/c1-13-7-4-5(10)3-6(9(11)12)8(7)14-2/h3-4H,1-2H3,(H,11,12) |
| InChI Key | ZKMWQUDSDYOEJQ-UHFFFAOYSA-N |
| MSDS | msds/143110_1_72517_23_8.pdf |
| 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:C9H9BrO4 Molecular weight:261.1 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, 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 HS Code 2918990090 Synthetic Route Benzaldehyde,5-... 71295-21-1 Benzoic acid,5-... 72517-23-8 Literature: Daukshas, V. K.; Martinkus, R. S.; Kuleshyus, V. A.; Shtel'bene, V. P. Journal of Organic Chemistry USSR (English Translation), 1983 , vol. 19, p. 458 - 463 Zhurnal Organicheskoi Khimii, 1983 , vol. 19, # 3 p. 522 - 528 Methyl 5-bromo-... 83131-08-2 Benzoic acid,5-... 72517-23-8 Literature: Mach, Robert H.; Hammond, Philip S.; Huang, Yunsheng; Yang, Biao; Xu, Yueping; Cheney, Jason T.; Freeman, Rebekah; Luedtke, Robert R. Medicinal Chemistry Research, 1999 , vol. 9, # 6 p. 355 - 373 5-Bromo-2,3-dih... 72517-15-8 Dimethyl sulfat... Benzoic acid,5-... 72517-23-8 Literature: Huang, Yunsheng; Luedtke, Robert R.; Freeman, Rebekah A.; Wu, Li; Mach, Robert H. Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 12 p. 3113 - 3122 Title/Abstract View citing articles Show Details Tiwari, Shashi B.; Kohli Medicinal Chemistry Research, 2008 , vol. 17, # 2-7 p. 386 - 398 Precursor & DownStream Precursor 10 CAS#:71295-21-1 Benzaldehyde,5-... CAS#:83131-08-2 Methyl 5-bromo-... CAS#:72517-15-8 5-Bromo-2,3-dih... CAS#:77-78-1 Dimethyl sulfate DownStream 6 CAS#:107188-74-9 (-)-(2S,3S)-2,3... CAS#:164670-73-9 5-BROMO-2,3-DIM... CAS#:107188-87-4 epidepride CAS#:76959-16-5 2-(2,3-dimethox... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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