CAS
94813-61-3 Purity
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94813-61-3 Purity
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The molecular formula is C8H10N2O2.
It was created on July 9, 2005.
The IUPAC name is 6-methyl-5-prop-2-enyl-1H-pyrimidine-2,4-dione.
The InChI is InChI=1S/C8H10N2O2/c1-3-4-6-5(2)9-8(12)10-7(6)11/h3H,1,4H2,2H3,(H2,9,10,11,12).
The InChIKey is KWHYPGGBFHXFLD-UHFFFAOYSA-N.
The canonical SMILES is CC1=C(C(=O)NC(=O)N1)CC=C.
The CAS number is 94815-68-6.
The ChEMBL ID is CHEMBL2131334.
The molecular weight is 166.18 g/mol.
Yes, it is canonicalized in PubChem.