CAS
55404-31-4 Purity
98%
55404-31-4 Purity
98%
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The molecular formula is C4H2BrClN2.
The molecular weight is 193.43 g/mol.
The IUPAC name is 2-bromo-5-chloropyrimidine.
The InChI is InChI=1S/C4H2BrClN2/c5-4-7-1-3(6)2-8-4/h1-2H.
The InChIKey is QZOXTQMVQQUSCA-UHFFFAOYSA-N.
The Canonical SMILES is C1=C(C=NC(=N1)Br)Cl.
The CAS number is 124405-67-0.
The XLogP3-AA value is 1.9.
The hydrogen bond donor count is 0.
Yes, 5-Chloro-2-bromopyrimidine is canonicalized.