4-[(4,5-DIHYDRO-3-METHYL-5-OXO-1-PHENYL-1H-PYRAZOL-4-YL)AZO]BENZOIC ACID
4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoic acid
| Molecular Formula | C17H14N4O3 |
|---|---|
| Molecular Weight | 322.32 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 94.7 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1066 |
| Heavy Atoms | 24 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 30926-22-8 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3 |
| InChIKey | RCYTWTBFGNSMQC-UHFFFAOYSA-N |
📖 Product Overview
4-[(4,5-DIHYDRO-3-METHYL-5-OXO-1-PHENYL-1H-PYRAZOL-4-YL)AZO]BENZOIC ACID (CAS: 30926-22-8) is a chemical compound with molecular formula C17H14N4O3 and molecular weight 322.32 g/mol. Its IUPAC systematic name is 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoic acid.
RCYTWTBFGNSMQC-UHFFFAOYSA-N.
SMILES: CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3.
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