5-Allyl-5-(2,3-epoxypropyl)barbituric acid
5-(oxiran-2-ylmethyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: Allobarbital epoxide|NIOSH/CP8412700|5-Allyl-5-(2,3-epoxypropyl)barbituric acid|5-Allyl-5-(oxiranylmethyl)barbituric acid|Barbituric acid, 5-allyl-5-(2,3-epoxypropyl)-|5-(oxiran-2-ylmethyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione|5-(Oxiranylmethyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(oxiranylmethyl)-5-(2-propenyl)-|5-[(oxiran-2-yl)methyl]-5-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione|4,6-Dihydroxy-5-[(oxiran-2-yl)methyl]-5-(prop-2-en-1-yl)pyrimidin-2(5H)-one
| Molecular Formula | C10H12N2O4 |
|---|---|
| Molecular Weight | 224.07971 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 87.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.07971 |
| Monoisotopic Mass | 224.07971 |
| Heavy Atoms | 16 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 65685-97-4 |
|---|---|
| SMILES | C=CCC1(C(=O)NC(=O)NC1=O)CC2CO2 |
| InChIKey | FGXVEFBZEIUCGV-UHFFFAOYSA-N |
Product Overview
5-Allyl-5-(2,3-epoxypropyl)barbituric acid (CAS 65685-97-4), with molecular formula C10H12N2O4 and molecular weight 224.07971 g/mol. IUPAC: 5-(oxiran-2-ylmethyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione.
5-Allyl-5-(2,3-epoxypropyl)barbituric acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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