3-(Pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-(pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: 3-(pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid|NCI60_004107|2-(pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-3-carboxylic acid|1H-2-Benzopyran-5-carboxylicacid,octahydro-1-oxo|3-((2-pyrimidinylamino)carbonyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid|3-(pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylicacid|3-[(PYRIMIDIN-2-YL)CARBAMOYL]-7-OXABICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID
| Molecular Formula | C12H11N3O4 |
|---|---|
| Molecular Weight | 261.07495 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.07495 |
| Monoisotopic Mass | 261.07495 |
| Heavy Atoms | 19 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 7145-88-2 |
|---|---|
| SMILES | C1=CN=C(N=C1)NC(=O)C2C3C=CC(C2C(=O)O)O3 |
| InChIKey | QMDVGAHLIPJCNF-UHFFFAOYSA-N |
Product Overview
3-(Pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid (CAS 7145-88-2), with molecular formula C12H11N3O4 and molecular weight 261.07495 g/mol. IUPAC: 3-(pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
3-(Pyrimidin-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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