CAS
1262985-26-1 Purity
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1262985-26-1 Purity
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The molecular formula is C5H5ClIN3.
The molecular weight is 269.47 g/mol.
The IUPAC name is 5-chloro-6-iodopyridine-2,3-diamine.
The InChI is InChI=1S/C5H5ClIN3/c6-2-1-3(8)5(9)10-4(2)7/h1H,8H2,(H2,9,10).
The InChIKey is HMQJGGSXOZIWMD-UHFFFAOYSA-N.
The Canonical SMILES is C1=C(C(=NC(=C1Cl)I)N)N.
The CAS number is 1394373-23-9.
The XLogP3-AA is 1.1.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 3.