4-Bromobenzoic acid
- CAS No.
- 586-76-5
- Chemical Name:
- 4-Bromobenzoic acid
- Synonyms
- P-BROMOBENZOIC ACID;Benzoic acid, p-bromo-;4-bromo-benzoicaci;4-Bromobenzoic aicd;Benzoicacid,4-bromo-;'LGC' (4008);Homarine HCL;4-Brombenzoesure;AKOS BBS-00003716;p-bromo-benzoicaci
- CBNumber:
- CB1490484
- Molecular Formula:
- C7H5BrO2
- Molecular Weight:
- 201.02
- MDL Number:
- MFCD00002529
- MOL File:
- 586-76-5.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 252-254 °C (lit.) |
|---|---|
| Boiling point | 116 °C(Press: 15-16 Torr) |
| Density | 1,894 g/cm3 |
| refractive index | 1.6080 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | ethanol: soluble5% |
| form | Crystals or Powder |
| pka | 3.96(at 25℃) |
| color | White to beige to pink-brownish |
| Water Solubility | SOLUBLE IN HOT WATER |
| Merck | 14,1408 |
| BRN | 1906923 |
| Stability | Stable. Incompatible with strong oxidizing agents. |
| Cosmetics Ingredients Functions | SKIN CONDITIONING |
| InChI | 1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10) |
| InChIKey | TUXYZHVUPGXXQG-UHFFFAOYSA-N |
| SMILES | OC(=O)c1ccc(Br)cc1 |
| CAS DataBase Reference | 586-76-5(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | 6992P6102O |
| NIST Chemistry Reference | Benzoic acid, 4-bromo-(586-76-5) |
| EPA Substance Registry System | 4-Bromobenzoic acid (586-76-5) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |  GHS07 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H302 | |||||||||
| Precautionary statements | P264-P270-P301+P312-P501 | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 22-36/37/38-36-37/38 | |||||||||
| Safety Statements | 26-36-24/25-22-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | DG4448050 | |||||||||
| Hazard Note | Irritant | |||||||||
| TSCA | TSCA listed | |||||||||
| HS Code | 29163900 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral | |||||||||
| NFPA 704 |
|
4-Bromobenzoic acid price More Price(92)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | 108510 | 4-Bromobenzoic acid 98% | 586-76-5 | 25g | $58 | 2026-04-30 | Buy |
| Sigma-Aldrich | 108510 | 4-Bromobenzoic acid 98% | 586-76-5 | 100g | $131 | 2026-04-30 | Buy |
| TCI Chemical | B0553 | 4-Bromobenzoic Acid >98.0%(GC)(T) | 586-76-5 | 25g | $46 | 2026-04-30 | Buy |
| TCI Chemical | B0553 | 4-Bromobenzoic Acid >98.0%(GC)(T) | 586-76-5 | 100g | $133 | 2026-04-30 | Buy |
| Strem Chemicals | 06-0124 | 4-Bromobenzoic acid, min. 98% min.98% | 586-76-5 | 25g | $65 | 2026-04-30 | Buy |
4-Bromobenzoic acid Chemical Properties,Uses,Production
Chemical Properties
White to light yellow crystal powder
Uses
4-Bromobenzoic acid was used to study the metabolic fate of 2-,3-and 4-bromo benzoic acids in rat hepatocytes incubation using high temperature liquid chromatography. It was used in bromine-specific detection of the metabolites of 2-,3-and 4-bromobenzoic acid in the urine and bile of rats by inductively coupled plasma mass spectrometry. It is also used as an intermediate for the synthesis of agrochemicals, pharmaceutical, chemical intermediates and liquid crystals.
Preparation
4-Bromobenzoic acid is obtained by the reaction of p-bromotoluene with glacial acetic acid as the molten agent and oxygen as the oxidant, utilising a liquid-phase oxidation catalytic method under the action of a catalyst. The catalyst is a combination of acetic acid cobalt, manganese acetate, and bromide compounds.
Definition
ChEBI: A bromobenzoic acid carrying a single bromo subsituent at the 4-position.
Synthesis Reference(s)
Synthetic Communications, 17, p. 457, 1987 DOI: 10.1080/00397918708063924
Tetrahedron Letters, 18, p. 4631, 1977
General Description
Colorless to red crystals.
Reactivity Profile
Carboxylic acids donate hydrogen ions if a base is present to accept them. They react in this way with all bases, both organic (for example, the amines) and inorganic. Their reactions with bases, called "neutralizations", are accompanied by the evolution of substantial amounts of heat. Neutralization between an acid and a base produces water plus a salt. Carboxylic acids with six or fewer carbon atoms are freely or moderately soluble in water; those with more than six carbons are slightly soluble in water. Soluble carboxylic acid dissociate to an extent in water to yield hydrogen ions. The pH of solutions of carboxylic acids is therefore less than 7.0. Many insoluble carboxylic acids react rapidly with aqueous solutions containing a chemical base and dissolve as the neutralization generates a soluble salt. Carboxylic acids in aqueous solution and liquid or molten carboxylic acids can react with active metals to form gaseous hydrogen and a metal salt. Such reactions occur in principle for solid carboxylic acids as well, but are slow if the solid acid remains dry. Even "insoluble" carboxylic acids may absorb enough water from the air and dissolve sufficiently in 4-Bromobenzoic acid to corrode or dissolve iron, steel, and aluminum parts and containers. Carboxylic acids, like other acids, react with cyanide salts to generate gaseous hydrogen cyanide. The reaction is slower for dry, solid carboxylic acids. Insoluble carboxylic acids react with solutions of cyanides to cause the release of gaseous hydrogen cyanide. Flammable and/or toxic gases and heat are generated by the reaction of carboxylic acids with diazo compounds, dithiocarbamates, isocyanates, mercaptans, nitrides, and sulfides. Carboxylic acids, especially in aqueous solution, also react with sulfites, nitrites, thiosulfates (to give H2S and SO3), dithionites (SO2), to generate flammable and/or toxic gases and heat. Their reaction with carbonates and bicarbonates generates a harmless gas (carbon dioxide) but still heat. Like other organic compounds, carboxylic acids can be oxidized by strong oxidizing agents and reduced by strong reducing agents. These reactions generate heat. A wide variety of products is possible. Like other acids, carboxylic acids may initiate polymerization reactions; like other acids, they often catalyze (increase the rate of) chemical reactions.
Health Hazard
ACUTE/CHRONIC HAZARDS: Explodes above its melting point.
Purification Methods
Crystallise the acid from MeOH, or MeOH/water mixture, 90% EtOH and Et2O. The methyl ester has m 81o from Et2O or dilute MeOH. The anilide has m 197o (from EtOH). [Male & Thorp J Am Chem Soc 35 269 1913, Lamneck J Am Chem Soc 76 406 1954, Vandenbelt et al. Anal Chem 26 926 1954, Beilstein 9 IV 1017.]
4-Bromobenzoic acid Preparation Products And Raw materials
Raw materials
Preparation Products
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| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| SHANDONG XINGRUNDA CHEMICAL CO.,LTD | 0534-18615348689 18615348689 | hclt1978@163.com | China | 35 | 58 |
| Shaanxi Dideu Medichem Co. Ltd | 029-81024372 17792795018 | 1053@dideu.com | China | 9999 | 58 |
| Shanghai Taijilin Industrial Co., Ltd. | 02150630626 17717886015 | kate@tajilin.com | China | 1340 | 58 |
| Shandong Vantage Specialty Chemicals Biotechnology Co., Ltd. | 13396369453 18678026865 | sdfantai@163.com | China | 904 | 58 |
| Shanghai Qiao Chemical Science Co., Ltd | 021-58892003 | info@qiaochem.com | China | 6065 | 65 |
| Jinan Dexinjia Bio&Tech Co., Ltd | 0531-82375880 15098789112 | 3845379039@qq.com | China | 1459 | 58 |
| Changzhou Pumelo Co.,Ltd. | 0519-81698808 13809072999 | pml@pmlchem.com | China | 64 | 55 |
| Wuxi Nanfang Chemistry Additives Co.,Ltd. | 0510-85580939 18261593783 | nanfangchem@126.com | China | 34 | 58 |
| Shanghai Binma Technology Co., Ltd. | 15262241608 | yzxiajie@163.com | China | 861 | 58 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
View Lastest Price from 4-Bromobenzoic acid manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2026-06-30 | 4-Bromobenzoic acid
586-76-5
|
1KG | 98% | 1000kg | Shaanxi Dideu New Materials Co. Ltd | ||
 |
2026-05-28 | 4-Bromobenzoic acid
586-76-5
|
$2.00-5.00 | 1KG | 99% | 10000kg | Hebei Chuanghai Biotechnology Co,.LTD | |
 |
2026-04-27 | 4-Bromobenzoic acid
586-76-5
|
1kg | 98% | 100tons | Shandong Vital Biotechnology Co., Ltd. |
-
- 4-Bromobenzoic acid
586-76-5
- $0.00
- 98%
- Shaanxi Dideu New Materials Co. Ltd
-
- 4-Bromobenzoic acid
586-76-5
- $2.00-5.00
- 99%
- Hebei Chuanghai Biotechnology Co,.LTD
-
- 4-Bromobenzoic acid
586-76-5
- 98%
- Shandong Vital Biotechnology Co., Ltd.
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