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CAS Number: 90914-41-3
3-bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine

Structure

3-bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine
Name: 3-bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine
Synonyms:
General Information
Product Number: 90914413

CAS Registry Number 90914-41-3
Name:
1H-​Pyrazolo[3,​4-​d]​pyrimidine, 3-​bromo-​4-​chloro-
3-Bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine
NSC 370382

 

Chemical Formula: C5H2BrClN4
Exact Mass: 231.92
Molecular Weight: 233.45
m/z: 233.91 (100.0%), 231.92 (77.4%), 235.91 (24.1%), 234.92 (5.4%), 232.92 (4.2%), 236.91 (1.7%), 234.91 (1.5%), 232.91 (1.1%)

 

InChI:InChI=1S/C5H2BrClN4/c6-3-2-4(7)8-1-9-5(2)11-10-3/h1H,(H,8,9,10,11)

InChI Key:MDFHFCAMBZNSLV-UHFFFAOYSA-N

Canonical SMILES:C1=NC2=NNC(=C2C(=N1)Cl)Br

Specification

98%

References

PCT Int. Appl. (2014), WO 2014118226 A1 20140807.

PCT Int. Appl. (2011), WO 2011149827 A1 20111201.                                  

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