RefChem:434831
2-[[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid
Also Known As: EINECS 274-920-8|1-(2-Chloro-6-methylphenyl)-3-methyl-4-((1-sulfo-2-naphthalenyl)azo)-2-pyrazolin-5-one|1-Naphthalenesulfonic acid, 2-((1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-|1-Naphthalenesulfonic acid, 2-(2-(1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)diazenyl)-|1-Naphthalenesulfonic acid, 2-[[1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-|1-Naphthalenesulfonic acid, 2-[2-[1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-|2-((1-(6-Chloro-o-tolyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)naphthalene-1-sulphonic acid|2-[[[1-(2-Chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol]-4-yl]azo]-1-naphthalenesulfonic acid|2-[[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid|2-[[1-(6-CHLORO-O-TOLYL)-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-4-YL]AZO]NAPHTHALENE-1-SULFONIC ACID|2-[[1-(6-chloro-o-tolyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]naphthalene-1-sulphonic acid|2-{[1-(2-Chloro-6-methylphenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}naphthalene-1-sulfonic acid|2-{2-[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]diazen-1-yl}naphthalene-1-sulfonic acid
| Molecular Formula | C21H17ClN4O4S |
|---|---|
| Molecular Weight | 456.06592 g/mol |
| LogP | 4.92 |
| Topological Polar Surface Area | 111.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 456.06592 |
| Heavy Atoms | 31 |
| Complexity | 1365.1 |
Chemical Identifiers
| CAS Number | 70833-47-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)N2C(=O)C(C(=N2)C)N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)O |
Product Overview
RefChem:434831 (CAS 70833-47-5), with molecular formula C21H17ClN4O4S and molecular weight 456.06592 g/mol. IUPAC: 2-[[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid.
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