CAS
89965-25-3 Purity
96%
89965-25-3 Purity
96%
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Specification
The molecular formula is C8H12N2O.
It was created on 2019-01-15 and last modified on 2023-12-30.
The IUPAC name is 2-methyl-4-propyl-1H-pyrimidin-6-one.
The InChI is InChI=1S/C8H12N2O/c1-3-4-7-5-8(11)10-6(2)9-7/h5H,3-4H2,1-2H3,(H,9,10,11).
The InChIKey is XANOWNHHKSIJHW-UHFFFAOYSA-N.
The Canonical SMILES is CCCC1=CC(=O)NC(=N1)C.
The molecular weight is 152.19 g/mol.
The XLogP3-AA value is 0.4.
It has 1 hydrogen bond donor count.
Yes, the compound is canonicalized.