AC1NSC3E
[4-(2-hydroxyphenyl)-5-methylpyrimidin-2-yl]cyanamide
Also Known As: 3-N-Dodecylaminopropan-1-ol|[4-(2-hydroxy-phenyl)-5-methyl-pyrimidin-2-yl]-cyanamide|[4-(2-Hydroxyphenyl)-5-methylpyrimidin-2-yl]cyanamide|[5-methyl-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]cyanamide|[5-methyl-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin|[(6E)-5-methyl-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]cyanamide|[[(4E)-5-methyl-4-(6-oxo-1-cyclohexa-2,4-dienylidene)-3H-pyrimidin-2-yl]amino]formonitrile
| Molecular Formula | C12H10N4O |
|---|---|
| Molecular Weight | 226.08546 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.08546 |
| Monoisotopic Mass | 226.08546 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 52872-49-8 |
|---|---|
| SMILES | CC1=CN=C(N=C1C2=CC=CC=C2O)NC#N |
| InChIKey | PRCHSCSZPKLVFS-UHFFFAOYSA-N |
Product Overview
AC1NSC3E (CAS 52872-49-8), with molecular formula C12H10N4O and molecular weight 226.08546 g/mol. IUPAC: [4-(2-hydroxyphenyl)-5-methylpyrimidin-2-yl]cyanamide.
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