ChemicalBook--->CAS DataBase List--->81971-39-3

81971-39-3

81971-39-3 Structure

81971-39-3 Structure
IdentificationBack Directory
[Name]

5-BROMO-1-METHYL-2(1H)-PYRIDINONE
[CAS]

81971-39-3
[Synonyms]

5-bromo-1-methylpyridone
5-BroMo-1-Methylpyridin-2...
5-Bromo-1-methyl-pyridin-2-one
5-Bromo-1-methyl-2(1H)-pyridone
5-BROMO-1-METHYL-2(1H)-PYRIDINONE
5-BroMo-1-Methyl-1H-pyridin-2-one
5-Bromo-1-methylpyridin-2(1H)-one
5-bromo-1-methyl-1,2-dihydropyridin-2-one
3-Bromo-1-methyl-6-oxo-1,6-dihydropyridine
[Molecular Formula]

C6H6BrNO
[MDL Number]

MFCD09972188
[MOL File]

81971-39-3.mol
[Molecular Weight]

188.03
Chemical PropertiesBack Directory
[Melting point ]

62-63℃
[Boiling point ]

258℃
[density ]

1.664
[Fp ]

110℃
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

-0.41±0.62(Predicted)
[color ]

White to Yellow to Orange
[InChI]

InChI=1S/C6H6BrNO/c1-8-4-5(7)2-3-6(8)9/h2-4H,1H3
[InChIKey]

HHVFVHIUOMMWRN-UHFFFAOYSA-N
[SMILES]

C1(=O)N(C)C=C(Br)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

5-BROMO-1-METHYL-2(1H)-PYRIDINONE(81971-39-3)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Hydroxy-5-bromopyridine

13466-38-1

Iodomethane

74-88-4

5-BROMO-1-METHYL-2(1H)-PYRIDINONE

81971-39-3

5-Bromopyridin-2(1H)-one (8.6 g, 0.05 mol) was dissolved in THF (120 mL) at 0 °C and slowly added to a suspension of NaH (4.8 g, 0.2 mol) in THF (10 mL). The reaction mixture was stirred at 0 °C for 1 hour. Subsequently, iodomethane (35.5 g, 0.25 mol) was added dropwise to the mixture and stirring was continued for 3 hours at room temperature. After completion of the reaction, the reaction was quenched with saturated aqueous NH4Cl solution. The organic phase was separated and concentrated to give the crude product. The crude product was purified by column chromatography to afford 5-bromo-1-methylpyridin-2(1H)-one (8.9 g, 96.78% yield).1H NMR (CDCl3): δ= 3.5 (s, 3H), 6.52 (m, 1H), 7.32 (m, 1H), 7.45 (m, 1H).

[References]

[1] Patent: US2010/331320, 2010, A1. Location in patent: Page/Page column 56
[2] Bioorganic and Medicinal Chemistry, 2017, vol. 25, # 14, p. 3649 - 3657
[3] Synlett, 2015, vol. 26, # 11, p. 1557 - 1562
[4] Patent: WO2013/49559, 2013, A1. Location in patent: Page/Page column 68
[5] Patent: WO2005/44195, 2005, A2. Location in patent: Page/Page column 40
81971-39-3 suppliers list
Company Name: Shanghai Amico Chemicals Co. LTD  Gold
Telephone: 微信 18019252918 18019252918
Website: www.amkchem.com
Company Name: Energy Chemical  
Telephone: 400-0056266
Website: www.energy-chemical.com
Company Name: Wuhan Chemwish Technology Co., Ltd  
Telephone: 86-027-67849912
Website: www.chemwish.com
Company Name: Tetranov Biopharm  
Telephone: 13526569071
Website: http://www.leadmedpharm.com/index.html
Company Name: Accela ChemBio Co.,Ltd.  
Telephone: 021-50795510 4000665055
Website: http://www.shao-yuan.com/
Company Name: Nan Jing Dirise Chemcial Co.,LTD  
Telephone: 025-52161033 15312098939
Website: www.njdrschem.com
Company Name: Nanjing Vital Chemical Co., Ltd.  
Telephone: Please Send Email 18652950785
Website: www.chemicalbook.com/ShowSupplierProductsList15337/0_EN.htm
Company Name: Chengdu HappySyn Pharmaceutical Technology Co., Ltd.  
Telephone: 85114309 18982182443
Website: www.happysyn.com
Company Name: Shanghai Topbiochem Technology Co., Ltd  
Telephone: 021-58170097
Website: www.topbiochem.com
Company Name: Jiangsu Aikon Biopharmaceutical R&D co.,Ltd.  
Telephone: 025-66113011 13913916777
Website: www.aikonchem.com/
Company Name: Shanghai Jian Chao Chemical Technology Co., Ltd.  
Telephone: 150-2103-5486 18017383231
Website:
Company Name: SuZhou ShiYa Biopharmaceuticals, Inc.  
Telephone: 86(512)5235 8471 17715136450
Website: www.shiyabiopharm.com
Company Name: 9ding chemical ( Shanghai) Limited  
Telephone: 4009209199
Website: www.9dingchem.com
Company Name: Shanghai Aladdin Bio-Chem Technology Co.,LTD  
Telephone: 400-6206333 13167063860
Website: www.aladdin-e.com/
Company Name: Amatek Scientific Co. Ltd.  
Telephone: 0512-56316828 4008675858
Website: http://www.amateksci.com
Company Name: Bide Pharmatech Ltd.  
Telephone: 400-164-7117 18317119277
Website: www.bidepharm.com
Company Name: Nanjing Chalf-Pharm Technology Co., Ltd.  
Telephone: 025-57018978 18251899859
Website: http://www.chalf-pharm.com
Company Name: Jiangsu Mingchem Corporation  
Telephone: 0519-85170101
Website: http://www.mingchem.com
Tags:81971-39-3 Related Product Information