CAS
941294-25-3 Purity
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941294-25-3 Purity
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The molecular formula is C7H10ClN3.
The molecular weight is 171.63 g/mol.
It was created on December 5, 2007.
The IUPAC name is 6-chloro-N-propylpyrimidin-4-amine.
The InChI is InChI=1S/C7H10ClN3/c1-2-3-9-7-4-6(8)10-5-11-7/h4-5H,2-3H2,1H3,(H,9,10,11).
The InChIKey is XWORSYQRPFDXTA-UHFFFAOYSA-N.
The Canonical SMILES is CCCNC1=CC(=NC=N1)Cl.
It has 1 hydrogen bond donor count.
The topological polar surface area is 37.8 Ų.
Yes, it is a canonicalized compound.