![Methyl 4-[(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)methyl]benzoate structure](/static/products/4113/4113-95-5.webp)
Methyl 4-[(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)methyl]benzoate
methyl 4-[(2,4-dioxopyrimidin-1-yl)methyl]benzoate
Also Known As: NCIOpen2_006445|methyl 4-[(2,4-dioxopyrimidin-1-yl)methyl]benzoate|methyl 4-[(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)methyl]benzoate|Benzoic acid,4-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methyl]-, methyl ester
CAS: 4113-95-5
| Molecular Formula | C13H12N2O4 |
|---|---|
| Molecular Weight | 260.0797 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.0797 |
| Monoisotopic Mass | 260.0797 |
| Heavy Atoms | 19 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 4113-95-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)CN2C=CC(=O)NC2=O |
| InChIKey | MCDYZLDVCBRFNY-UHFFFAOYSA-N |
Product Overview
Methyl 4-[(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)methyl]benzoate (CAS 4113-95-5), with molecular formula C13H12N2O4 and molecular weight 260.0797 g/mol. IUPAC: methyl 4-[(2,4-dioxopyrimidin-1-yl)methyl]benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Methyl 4-[(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)methyl]benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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