1,5-Naphthalenedisulfonic acid, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-
3-(3-methyl-5-oxo-4H-pyrazol-1-yl)naphthalene-1,5-disulfonic acid
Also Known As: ChemDiv1_017500|EINECS 229-926-5|HMS636L10|1,5-Naphthalenedisulfonic acid, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-|3-(3-methyl-5-oxo-4,5-dihydro-1h-pyrazol-1-yl)naphthalene-1,5-disulfonic acid|3-(3-methyl-5-oxo-4H-pyrazol-1-yl)naphthalene-1,5-disulfonic acid|3-(3-methyl-5-oxo-2H-pyrazol-1(5H)-yl)naphthalene-1,5-disulfonic acid|1-(4,8-Disulfonaphthalen-2-yl)-3-methyl-1H-pyrazol-5(4H)-one|1,5-Naphthalenedisulfonic acid, 3-(3-methyl-5-oxo-2-pyrazolin-1-yl)-|1,5-Naphthalenedisulfonic acid, 3-(5-hydroxy-3-methyl-1H-pyrazol-1-yl)-|3-(3-Methyl-5-oxo-4,5-dihydropyrazol-1-yl)naphthalene-1,5-disulfonic acid|3-(5-Hydroxy-3-methyl-1H-pyrazol-1-yl)-1,5-naphthalenedisulfonic acid|1,5-Naphthalenedisulfonicacid, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-|3-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-1,5-naphthalenedisulfonic acid|3-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)naphthalene-1,5-disulphonic acid
| Molecular Formula | C14H12N2O7S2 |
|---|---|
| Molecular Weight | 384.0086 g/mol |
| LogP | 1.45 |
| Topological Polar Surface Area | 141.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.0086 |
| Heavy Atoms | 25 |
| Complexity | 1151.2 |
Chemical Identifiers
| CAS Number | 6838-01-3 |
|---|---|
| SMILES | CC1=NN(C(=O)C1)C2=CC3=C(C=CC=C3S(=O)(=O)O)C(=C2)S(=O)(=O)O |
Product Overview
1,5-Naphthalenedisulfonic acid, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)- (CAS 6838-01-3), with molecular formula C14H12N2O7S2 and molecular weight 384.0086 g/mol. IUPAC: 3-(3-methyl-5-oxo-4H-pyrazol-1-yl)naphthalene-1,5-disulfonic acid.
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