259794-06-4 Purity
97%
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Specification
The molecular formula is C4H2BrFN2.
The molecular weight is 176.97 g/mol.
The IUPAC name is 2-bromo-5-fluoropyrazine.
The InChI is InChI=1S/C4H2BrFN2/c5-3-1-8-4(6)2-7-3/h1-2H.
The InChIKey is XPWYTZGWNXDFRE-UHFFFAOYSA-N.
The canonical SMILES is C1=C(N=CC(=N1)Br)F.
The CAS number is 1209459-10-8.
The EC number is 810-677-1.
The hydrogen bond donor count is 0.
Yes, 2-Bromo-5-fluoropyrazine is a canonicalized compound.
Reference: [1] Patent: US2005/9838, 2005, A1, . Location in patent: Page 150
Reference: [1]Patent: US2005/9838,2005,A1 .Location in patent: Page 150
Reference: [1]Patent: US2005/9838,2005,A1 .Location in patent: Page 151
* For details of the synthesis route, please refer to the original source to ensure accuracy.