CAS
944899-63-2 Purity
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944899-63-2 Purity
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Specification
The molecular formula is C9H11N3O2.
The molecular weight is 193.20 g/mol.
It was created on 2009-05-28.
The IUPAC name is 2-morpholin-4-ylpyrimidine-4-carbaldehyde.
The InChI is InChI=1S/C9H11N3O2/c13-7-8-1-2-10-9(11-8)12-3-5-14-6-4-12/h1-2,7H,3-6H2.
The Canonical SMILES is C1COCCN1C2=NC=CC(=N2)C=O.
The XLogP3-AA value is 0.1.
It has 5 hydrogen bond acceptor counts.
The topological polar surface area is 55.3 Å2.
Yes, the compound is canonicalized.