![methyl 2-{[(5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]amino}acetate structure](/static/products/3389/338975-52-3.webp)
methyl 2-{[(5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]amino}acetate
methyl 2-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylideneamino]acetate
Also Known As: methyl 2-{[(5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]amino}acetate|methyl 2-{[(5-oxo-3-phenyl-4,5-dihydro-1H-pyrazol-4-ylidene)methyl]amino}acetate|9B-101|methyl 2-[(5-oxo-3-phenyl-1H-pyrazol-4-ylidene)methylamino]acetate|methyl 2-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylideneamino]acetate|methyl 2-[[(Z)-(5-oxo-3-phenyl-1H-pyrazol-4-ylidene)methyl]amino]acetate|Methyl 2-[(3-oxo-5-phenyl-2H-pyrazol-4-ylidene)methylamino]acetate|methyl 2-{[(3-oxo-5-phenyl-2H-pyrazol-4-ylidene)methyl]amino}acetate|methyl 2-{[(3-oxo-5-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methylidene]amino}acetate|methyl2-{[(5-oxo-3-phenyl-4,5-dihydro-1H-pyrazol-4-ylidene)methyl]amino}acetate
| Molecular Formula | C13H13N3O3 |
|---|---|
| Molecular Weight | 259.0957 g/mol |
| LogP | 0.9619 |
| Topological Polar Surface Area | 87.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0957 |
| Monoisotopic Mass | 259.0957 |
| Heavy Atoms | 19 |
| Complexity | 640.6531 |
Chemical Identifiers
| CAS Number | 338975-52-3 |
|---|---|
| SMILES | COC(=O)CN=CC1=C(NNC1=O)C2=CC=CC=C2 |
Product Overview
methyl 2-{[(5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]amino}acetate (CAS 338975-52-3), with molecular formula C13H13N3O3 and molecular weight 259.0957 g/mol. IUPAC: methyl 2-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylideneamino]acetate.