| Methyl 3-bromobenzoate Basic information |
| Product Name: | Methyl 3-bromobenzoate |
| Synonyms: | METHYL 3-BROMOBENZOATE FOR SYNTHESIS;3-bromo-benzoicacimethylester;Benzoic acid, m-bromo-, methyl ester;Benzoicacid,3-bromo-,methylester;m-Bromobenzoic acid methyl ester;RARECHEM AL BF 0052;3-BROMOBENZOIC ACID METHYL ESTER;Methyl 3-bromobenzoate, 98+% |
| CAS: | 618-89-3 |
| MF: | C8H7BrO2 |
| MW: | 215.04 |
| EINECS: | 210-569-9 |
| Product Categories: | Aromatic Esters;API intermediates;Acids & Esters;Bromine Compounds;C8 to C9;Carbonyl Compounds;Acids and Derivatives;Esters;Building Blocks;C8 to C9;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks |
| Mol File: | 618-89-3.mol |
| Methyl 3-bromobenzoate Chemical Properties |
| Melting point | 31-33 °C(lit.) |
| Boiling point | 127-128 °C15 mm Hg(lit.) |
| density | 1.5313 (rough estimate) |
| refractive index | 1.5575 |
| Fp | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | Crystalline Solid or Liquid |
| color | White to light yellow |
| Water Solubility | Slightly soluble in water. |
| BRN | 1940810 |
| InChIKey | KMFJVYMFCAIRAN-UHFFFAOYSA-N |
| CAS DataBase Reference | 618-89-3(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzoic acid, 3-bromo-, methyl ester(618-89-3) |
| EPA Substance Registry System | Benzoic acid, 3-bromo-, methyl ester (618-89-3) |
| Safety Information |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 37/39-26-24/25 |
| WGK Germany | 3 |
| TSCA | Yes |
| HS Code | 29163990 |
| MSDS Information |
| Provider | Language |
|---|---|
| Methyl 3-bromobenzoate | English |
| SigmaAldrich | English |
| ACROS | English |
| ALFA | English |
| Methyl 3-bromobenzoate Usage And Synthesis |
| Chemical Properties | Methyl 3-bromobenzoate is white to light yellow low melting crystalline |
| Uses | Methyl 3-bromobenzoate is an halogenated benzoate derivative used as a reagent in organic synthesis.Methyl 3-bromobenzoate is used in the synthesis of a novel series of tetrahydro dibenzazocine as inhibitors of 17β-hydroxysteroid dehydrogenase type 3. |
| Uses | Methyl 3-bromobenzoate is used as a reagent in organic synthesis. It is used in the synthesis of tetrahydro dibenzazocine, which acts as an inhibitor of 17beta-hydroxysteroid dehydrogenase type 3. Further, it is used to prepare 3-tert-butylphosphanyl-benzoic acid methyl ester by reacting with tert-butyltrimethylsilylphosphine. |
| General Description | Methyl 3-bromobenzoate is an aryl bromide. It undergoes stereoconvergent cross-coupling with potassium trifluoro(1-phenylethyl)borate to form 1,1-diarylethane derivative. The Negishi cross-coupling reaction between methyl 3-bromobenzoate and diarylzinc reagents in the presence of a palladium catalyst has been reported. Methyl-3-bromobenzoate can be converted into the corresponding benzonitrile using dichloro[bis{1-(dicyclohexylphosphanyl)piperidine}]palladium as a C-C cross-coupling catalyst and K4[Fe(CN)6] as a cyanating agent. |
| Methyl 3-bromobenzoate Preparation Products And Raw materials |
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