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Specification
The molecular formula is C11H12N2O3.
The molecular weight is 220.22 g/mol.
The IUPAC name is 4,6-dimethyl-2-oxo-3H-pyrido[1,2-a]pyrimidine-4-carboxylic acid.
The InChI is InChI=1S/C11H12N2O3/c1-7-4-3-5-8-12-9(14)6-11(2,10(15)16)13(7)8/h3-5H,6H2,1-2H3,(H,15,16).
The InChIKey is DITIYMYKXHWNFI-UHFFFAOYSA-N.
The Canonical SMILES is CC1=CC=CC2=NC(=O)CC(N12)(C)C(=O)O.
The CAS number is 956783-58-7.
The XLogP3-AA value is 0.1.
The compound has 1 hydrogen bond donor count.
The compound has 3 hydrogen bond acceptor counts.