| Identification | Back Directory | [Name]
3-BROMO-PYRAZOLO[1,5-A]PYRIMIDINE | [CAS]
55405-67-9 | [Synonyms]
3-Bromopyrazolo[1,5-a]pyr...
3-BROMO-PYRAZOLO[1,5-A]PYRIMIDINE
Pyrazolo[1,5-a]pyrimidine, 3-bromo-
3-BROMO-PYRAZOLO[1,5-A]PYRIMIDINE ISO 9001：2015 REACH | [Molecular Formula]
C6H4BrN3 | [MDL Number]
MFCD09832893 | [MOL File]
55405-67-9.mol | [Molecular Weight]
198.03 |
| Chemical Properties | Back Directory | [Melting point ]
158-159℃ | [density ]
1.89 | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
solid | [pka]
-1.25±0.40(Predicted) | [Appearance]
Light yellow to brown Solid | [InChI]
InChI=1S/C6H4BrN3/c7-5-4-9-10-3-1-2-8-6(5)10/h1-4H | [InChIKey]
MFJWRPLBWPDHGV-UHFFFAOYSA-N | [SMILES]
C12=C(Br)C=NN1C=CC=N2 |
| Hazard Information | Back Directory | [Synthesis]
General procedure for the synthesis of 3-bromopyrazolo[1,5-a]pyrimidines from pyrazolo[1,5-a]pyrimidines: pyrazolo[1,5-a]pyrimidines (1 g, 8.39 mmol) were dissolved in acetonitrile (5 mL), followed by addition of N-bromosuccinimide (NBS, 1.494 g, 8.39 mmol). The reaction mixture was stirred at room temperature for 8 hours. + (calculated value C6H5BrN3: 198.0); LC-MS retention time (Method A2): tR = 1.43 min. | [References]
[1] Patent: WO2017/59080, 2017, A1. Location in patent: Page/Page column 256; 257 |
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