4,5-Dihydro-5-oxo-1-((4-sulphophenyl)methyl)-1H-pyrazole-3-carboxylic acid
5-oxo-1-[(4-sulfophenyl)methyl]-4H-pyrazole-3-carboxylic acid
Also Known As: EINECS 276-081-3|4,5-Dihydro-5-oxo-1-((4-sulphophenyl)methyl)-1H-pyrazole-3-carboxylic acid|5-oxo-1-[(4-sulfophenyl)methyl]-4H-pyrazole-3-carboxylic acid|1H-Pyrazole-3-carboxylicacid, 4,5-dihydro-5-oxo-1-[(4-sulfophenyl)methyl]-|4,5-dihydro-5-oxo-1-[ methyl]-1H-pyrazole-3-carboxylicacid|5-Oxo-1-[(4-sulfophenyl)methyl]-4,5-dihydro-1H-pyrazole-3-carboxylic acid|4,5-Dihydro-5-oxo-1-(4-sulfobenzyl)-1H-pyrazole-3-carboxylic acid|4,5-dihydro-5-oxo-1-[(4-sulphophenyl)methyl]-1H-pyrazole-3-carboxylic acid
| Molecular Formula | C11H10N2O6S |
|---|---|
| Molecular Weight | 298.02597 g/mol |
| LogP | 0.1062 |
| Topological Polar Surface Area | 124.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.02597 |
| Monoisotopic Mass | 298.02597 |
| Heavy Atoms | 20 |
| Complexity | 692.1285 |
Chemical Identifiers
| CAS Number | 71849-96-2 |
|---|---|
| SMILES | C1C(=NN(C1=O)CC2=CC=C(C=C2)S(=O)(=O)O)C(=O)O |
Product Overview
4,5-Dihydro-5-oxo-1-((4-sulphophenyl)methyl)-1H-pyrazole-3-carboxylic acid (CAS 71849-96-2), with molecular formula C11H10N2O6S and molecular weight 298.02597 g/mol. IUPAC: 5-oxo-1-[(4-sulfophenyl)methyl]-4H-pyrazole-3-carboxylic acid.
4,5-Dihydro-5-oxo-1-((4-sulphophenyl)methyl)-1H-pyrazole-3-carboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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