ChemicalBook--->CAS DataBase List--->71149-52-5

71149-52-5

71149-52-5 Structure

71149-52-5 Structure
IdentificationBack Directory
[Name]

4-Chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine
[CAS]

71149-52-5
[Synonyms]

-7H-pyrroL
4-Chloro-2-methyl-7H-pyr
4-Chloro-2-methyl-7H-pyrrolo
2-methyl-4-chloro-pyrrolopyrimidine
4-Chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine
4-chloro-2-methyl-7H-pyrrolo[2,3-d]pyrimidine
1H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-2-methyl-
7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-2-methyl-
4-Chloro-2-methyl-7H-pyrrolo[2,3-d]pyrimidine 98%
[Molecular Formula]

C7H6ClN3
[MDL Number]

MFCD09746275
[MOL File]

71149-52-5.mol
[Molecular Weight]

167.6
Chemical PropertiesBack Directory
[Melting point ]

207-208 °C
[Boiling point ]

290.5±50.0 °C(Predicted)
[density ]

1.51±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

solid
[pka]

11.49±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C7H6ClN3/c1-4-10-6(8)5-2-3-9-7(5)11-4/h2-3H,1H3,(H,9,10,11)
[InChIKey]

HCFJHJBEGJJOMO-UHFFFAOYSA-N
[SMILES]

Cc1nc(Cl)c2cc[nH]c2n1
Safety DataBack Directory
[Risk Statements ]

36
[Safety Statements ]

26
[RIDADR ]

2811
[WGK Germany ]

3
[HazardClass ]

6.1
[PackingGroup ]

Ⅲ
[HS Code ]

2933998090
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Spectrum DetailBack Directory
[Spectrum Detail]

4-Chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine(71149-52-5)1HNMR
Hazard InformationBack Directory
[Synthesis]

4H-Pyrrolo[2,3-d]pyrimidin-4-one, 1,7-dihydro-2-methyl- (9CI)

89792-11-0

4-Chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine

71149-52-5

General procedure for the synthesis of 4-chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine using 2-methyl-1H-pyrrolo[2,3-d]pyrimidin-4(7H)-one as starting material: 90 mg (0.60 mmol) of hydroxypyrrolo[pyrimidin-4(7H)-one was suspended in 2 mL of phosphorochloridic acid chloride, and the reaction was heated and refluxed for 2 hours. Upon completion of the reaction, excess phosphorus trichloride was removed by distillation under reduced pressure. The residue was carefully quenched with an ice water bath and subsequently extracted with ethyl acetate. The organic phases were combined, washed with saturated brine, dried over anhydrous magnesium sulfate and concentrated under reduced pressure to remove the solvent. The crude product was purified by silica gel fast column chromatography (eluent: 10% methanol/dichloromethane) to afford the target compound 4-chloro-2-methyl-1H-pyrrolo[2,3-d]pyrimidine as a colorless solid (86 mg, 85% yield). Mass spectrometry result: (M + H)+ m/z = 168.

[References]

[1] Patent: WO2009/9740, 2009, A1. Location in patent: Page/Page column 71; 72
[2] Patent: WO2016/91774, 2016, A1. Location in patent: Page/Page column 36
71149-52-5 suppliers list
Company Name: Shanghai Boyle Chemical Co., Ltd.  
Telephone:
Website: www.boylechem.com
Company Name: Capot Chemical Co., Ltd  
Telephone: +86 (0) 571 85 58 67 18
Website: www.capotchem.com
Company Name: Shanghai Sinch Parmaceuticals Tech. Co. Ltd.  
Telephone: +86-21-54098501
Website: www.sinch.com.cn
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: Shanghai Longsheng chemical Co.,Ltd.  
Telephone: 58099637 13585536065
Website: www.shlshg.com
Company Name: EnciPharmatech Co., Ltd  
Telephone: 025-52714267-66 13813902930
Website: www.encipharma.com
Company Name: China Langchem Inc.  
Telephone: 0086-21-58956006
Website: www.chemicalbook.com/ShowSupplierProductsList19141/0_EN.htm
Company Name: Shanghai Sunway Pharmaceutical Technology Co., Ltd  
Telephone: 13761987713
Website: www.sunwaypharm.cn
Company Name: T&W GROUP  
Telephone: 021-61551611 13296011611
Website: www.trustwe.com/
Company Name: Shanghai Topbiochem Technology Co., Ltd  
Telephone: 021-58170097
Website: www.topbiochem.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: The future of Shanghai Industrial Co., Ltd.  
Telephone: 021-61552785
Website: www.jonln.com
Company Name: SynAsst Chemical.  
Telephone: 021-60343070
Website: www.chemicalbook.com/ShowSupplierProductsList15848/0_EN.htm
Company Name: Shanghai Arbor Chemical Co., Ltd.  
Telephone: 021-60451683 15021268886
Website: http://www.arborchemical.com
Company Name: CEG Chemical Science&Technology Co., Ltd.  
Telephone: Mobile:13665161512
Website: www.cegchemical.com
Company Name: Bide Pharmatech Ltd.  
Telephone: 400-164-7117 18317119277
Website: www.bidepharm.com
Tags:71149-52-5 Related Product Information
289-95-2 101200-48-0 119-36-8 872-50-4 120-94-5 99-76-3 96-33-3 67-56-1 143390-89-0 75-45-6