4-[(4-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
4-[(4-nitropyrazol-1-yl)methyl]benzoic acid
Also Known As: 4-[(4-Nitro-1H-pyrazol-1-yl)methyl]benzoic acid|Oprea1_725735|4-(4-Nitropyrazol-1-ylmethyl)benzoic acid|4-[(4-nitropyrazol-1-yl)methyl]benzoic acid|4-[(4-nitropyrazolyl)methyl]benzoic acid|Benzoic acid, 4-(4-nitro-1-pyrazolylmethyl)-|4-((4-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid|4-(4-Nitro-1H-pyrazol-1-yl)methylbenzoic acid|benzoic acid, 4-[(4-nitro-1H-pyrazol-1-yl)methyl]-|4-({4-nitro-1H-pyrazol-1-yl}methyl)benzoic acid|AK-968/41172235|4-[(4-Nitro-1H-pyrazol-1-yl)methyl]benzoic acid #|820-337-4|N/A
| Molecular Formula | C11H9N3O4 |
|---|---|
| Molecular Weight | 247.05931 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.05931 |
| Monoisotopic Mass | 247.05931 |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 514801-08-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=C(C=N2)[N+](=O)[O-])C(=O)O |
| InChIKey | RXZUBSJMBVABMA-UHFFFAOYSA-N |
Product Overview
4-[(4-nitro-1H-pyrazol-1-yl)methyl]benzoic acid (CAS 514801-08-2), with molecular formula C11H9N3O4 and molecular weight 247.05931 g/mol. IUPAC: 4-[(4-nitropyrazol-1-yl)methyl]benzoic acid.
4-[(4-nitro-1H-pyrazol-1-yl)methyl]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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