ChemicalBook--->CAS DataBase List--->38473-89-1

38473-89-1

38473-89-1 Structure

38473-89-1 Structure
IdentificationBack Directory
[Name]

3-BROMO-4-TERT-BUTYLBENZOICACID
[CAS]

38473-89-1
[Synonyms]

3-Bromo-4-(tert-butyl)
3-BROMO-4-TERT-BUTYLBENZOICACID
3-BroMo-4-tert-butylbenzoicbacid
3-Bromo-4-(1,1-dimethylethyl)-benzoic acid
[Molecular Formula]

C11H13BrO2
[MOL File]

38473-89-1.mol
[Molecular Weight]

257.12
Chemical PropertiesBack Directory
[Melting point ]

176.5 °C
[Boiling point ]

327.7±35.0 °C(Predicted)
[density ]

1.391±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

4.01±0.10(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
[HS Code ]

2916399090
Hazard InformationBack Directory
[Synthesis]

4-tert-Butylbenzoic acid

98-73-7

3-BROMO-4-TERT-BUTYLBENZOICACID

38473-89-1

4-tert-butylbenzoic acid (500 mg, 2.8 mmol) was dissolved in acetic acid (11 mL), nitric acid (1.7 mL) and bromine (114 μL, 5.9 mmol) were added with rapid stirring. Subsequently, a solution of silver nitrate (1.01 g, 5.9 mmol) in water (5 mL) was slowly added to the reaction system, at which point a thick yellow precipitate was observed to form. After addition of additional acetic acid (2 mL), the reaction mixture was heated to reflux for 1 hour. Upon completion of the reaction, the reaction solution was filtered while hot and water was added dropwise to the filtrate until a white solid precipitated. The solid was collected, air dried and purified by recrystallization from acetic acid to give finally 3-bromo-4-tert-butylbenzoic acid as a white solid (263 mg, 36% yield). The product was characterized by 1H NMR (CDCl3, 300 MHz): δ 1.85 (s, 9H, (CH3)3), 7.86 (d, 1H, J = 8.5 Hz, ArH), 8.26 (dd, 1H, J = 2.0, 8.5 Hz, ArH), 8.62 (d, 1H, J = 2.0 Hz, ArH).

[References]

[1] Patent: WO2012/4567, 2012, A2. Location in patent: Page/Page column 91
[2] Australian Journal of Chemistry, 1990, vol. 43, # 5, p. 807 - 814
[3] Patent: WO2010/142956, 2010, A2. Location in patent: Page/Page column 28-29
[4] Journal of the Chemical Society, 1958, p. 120,126
[5] Journal of the Chemical Society, 1958, p. 120,126
38473-89-1 suppliers list
Company Name: Chembest Research Laboratories Limited  
Telephone: 021-20908456
Website: www.biochembest.com
Company Name: Capot Chemical Co., Ltd  
Telephone: +86 (0) 571 85 58 67 18
Website: www.capotchem.com
Company Name: Tianjin heowns Biochemical Technology Co., Ltd.  
Telephone: 400 638 7771
Website: www.heowns.com
Company Name: Nanjing Norris-Pharm Technology Co., Ltd  
Telephone: 13901585132
Website:
Company Name: Acesys Pharmatech  
Telephone: 18860950986
Website: www.chemicalbook.com/ShowSupplierProductsList15849/0_EN.htm
Company Name: Shanghai HuanChuan Industry Co.,Ltd.  
Telephone: 021-61478794
Website: www.hcshhai.com
Company Name: SuZhou ShiYa Biopharmaceuticals, Inc.  
Telephone: 0512-0512-52358471 17715136450
Website: http://www.shiyabiopharm.com
Company Name: Amadis Chemical Company Limited  
Telephone: 571-89925085
Website: http://www.amadischem.com
Company Name: Cochemical Ltd.  
Telephone: 029-86115547 17791676824
Website: http://www.cochemical.com
Company Name: Capot Chemical Co.,Ltd.  
Telephone: +86-(0)57185586718 +86-13336195806
Website: www.capot.com/
Company Name: Aikon International Limited  
Telephone: 025-58859352 15955137747
Website: www.aikonchem.com
Company Name: SHANGHAI FDC-CHEMICAL CO.,LTD  
Telephone: 021-61469567 13774476675
Website: http://www.fdc-chemical.com/
Company Name: Tianjin heowns Biochemical Technology Co., Ltd.  
Telephone: 400-6387771-6039 18920764717
Website: www.heowns.com
Company Name: Shanghai Jizhi Biochemical Technology Co. Ltd.  
Telephone: 021-4009004166/18616739031 18616739031
Website: www.acmec-e.com/
Company Name: Dayang Chem (Hangzhou) Co.,Ltd.  
Telephone: +86-0571-88938639 17705817739
Website: www.dycnchem.com/
Company Name: Shanghai TenSus Biotechnology Co., Ltd.  
Telephone: 021-50895067 18616507272;13681616114;15020344067
Website: http://www.tqbiotech.com.cn/
Company Name: Zhejiang Lianshuo Biotechnology Co., Ltd.  
Telephone: 18616526224
Website: www.biolianshuo.com
Company Name: Nanjing Becas pharmatech Ltd.  
Telephone: +86-13912903754 13912903754
Website:
Tags:38473-89-1 Related Product Information
939-97-9 7681-82-5 99-94-5 68476-78-8 99070-17-4 6332-96-3