ChemDiv1_022229
ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate
Also Known As: ethyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate|ChemDiv1_022229|HMS650C09|KS-00001SUV|BAS 00342684|ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate|J1.628.582J|12L-936|AG-690/09453033|I11-980|ethyldioxophenylaahexahydropyrrolocpyrazolecarboxylate|1-(Di(aziridin-1-yl)phosphoryl)-3-(4-nitrophenyl)urea|ethyl 4,6-dioxo-5-phenyl-1H,3aH,4H,5H,6H,6aH-pyrrolo[3,4-c]pyrazole-3-carboxylate|ethyl 4,6-dioxo-5-phenyl-1H,3aH,6aH-pyrrolo[3,4-c]pyrazole-3-carboxylate|Ethyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexa hydropyrrolo[3,4-c]pyrazole-3-carboxylate|Ethyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c] pyrazole-3-carboxylate|Ethyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo3,4-cpyrazole-3-carboxylate|ethyl 4,6-dioxo-5-phenyl-3,5,3a,6a-tetrahydro-2,3,5-triazapentalenecarboxylate|4,6-Dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester
| Molecular Formula | C14H13N3O4 |
|---|---|
| Molecular Weight | 287.0906 g/mol |
| LogP | 0.0669 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.0906 |
| Monoisotopic Mass | 287.0906 |
| Heavy Atoms | 21 |
| Complexity | 640.879 |
Chemical Identifiers
| CAS Number | 2997-63-9 |
|---|---|
| SMILES | CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=CC=CC=C3 |
Product Overview
ChemDiv1_022229 (CAS 2997-63-9), with molecular formula C14H13N3O4 and molecular weight 287.0906 g/mol. IUPAC: ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate.