AC1MI5TH
1-(5-amino-2-methyl-3-sulfophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid
Also Known As: EINECS 274-947-5|1-(5-Amino-2-methyl-3-sulphophenyl)-4,5-dihydro-5-oxo-1H-pyrazole-3-carboxylic acid|1-(5-Amino-2-methyl-3-sulfophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-3-carboxylic acid|1H-Pyrazole-3-carboxylic acid, 1-(5-amino-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-|1-(5-amino-2-methyl-3-sulfophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid|1H-Pyrazole-3-carboxylicacid, 1-(5-amino-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-|1-(5-AMINO-2-METHYL-3-SULFOPHENYL)-4,5-DIHYDRO-5-OXO-1H-PYRAZOLE-3-CARBOXYLIC ACID
| Molecular Formula | C11H11N3O6S |
|---|---|
| Molecular Weight | 313.03687 g/mol |
| LogP | 0.00122 |
| Topological Polar Surface Area | 150.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.03687 |
| Monoisotopic Mass | 313.03687 |
| Heavy Atoms | 21 |
| Complexity | 783.39343 |
Chemical Identifiers
| CAS Number | 70862-30-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1S(=O)(=O)O)N)N2C(=O)CC(=N2)C(=O)O |
Product Overview
AC1MI5TH (CAS 70862-30-5), with molecular formula C11H11N3O6S and molecular weight 313.03687 g/mol. IUPAC: 1-(5-amino-2-methyl-3-sulfophenyl)-5-oxo-4H-pyrazole-3-carboxylic acid.
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