| Weight | 188.186 g/mol |
|---|---|
| Formula | C10H8N2O2 |
| Hydrogen Acceptors | 3 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 2 |
| Rotatable Bonds | 2 |
4-(1H-Pyrazol-1-yl)benzoic acid (16209-00-0)
16209-00-0
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- 4-[(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)iminomethyl]benzoic acid methanol solvate (Acta Crystallographica Section E: Crystallographic Communications, 2006)
- Syntheses and structures of three entangled coordination polymers based on the bifunctional ligand 4-((3-(pyridin-4-yl)-1H-pyrazol-1-yl)methyl)benzoic acid (Inorganica Chimica Acta, 2016)
- Synthesis and antimicrobial studies of novel derivatives of 4-(4-formyl-3-phenyl-1H-pyrazol-1-yl)benzoic acid as potent anti-Acinetobacter baumannii agents (Bioorganic & Medicinal Chemistry Letters, 2017)
- Synthesis and antimicrobial studies of azomethine and N-arylamine derivatives of 4-(4-formyl-3-phenyl-1H-pyrazol-1-yl)benzoic acid as potent anti-methicillin-resistant Staphylococcus aureus agents (Medicinal Chemistry Research, 2016)
- ChemInform Abstract: SYNTHESES AND BIOLOGICAL ACTIVITY OF HETEROCYCLES DERIVED FROM 4-(5-(2-FURANYL)-4,5-DIHYDRO-3-METHYL-1H-PYRAZOL-1-YL)BENZOIC ACID (ChemInform, 1985)
- Crystal structure of 4-(5-(benzoyloxy)-3-methyl-1H-pyrazol-1-yl)benzoic acid monohydrate, C18H16N2O5 (Zeitschrift Fur Kristallographie-new Crystal Structures, 2015)
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 16209-00-0
-
SMILESC1=CN(N=C1)C2=CC=C(C=C2)C(=O)O
-
InChIKeyXOEKYPIBVOGCDG-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 324.35 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 356.26 C | EPI Suite |
| Density | 1.3 g/cm3 | EPA T.E.S.T. |
| Flash Point | 177.33 C | EPA T.E.S.T. |
| Melting Point | 130.01 C | EPI Suite |
| Water Solubility | 519.24 mg/L | EPA T.E.S.T. |
| Water Solubility | 1594.6 mg/L | EPI Suite |
External Links
Synthesis
Similar Compounds
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N-methyl-1-[3-(1H-pyrazol-1-yl)phenyl]methanamine hydrochloride
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methyl 4-(5-amino-3-methyl-1H-pyrazol-1-yl)benzoate
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3,5-DIMETHYL-2-(1H-PYRAZOL-1-YL)BENZALDEHYDE
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1-(4-BUTYLPHENYL)-1H-PYRAZOLE-4-CARBALDEHYDE
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4-(5-oxo-3-propyl-2,5-dihydro-1H-pyrazol-1-yl)benzoic acid
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{[1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}methylamine hydrochloride
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4-(1H-Pyrazol-1-yl)benzoic acid
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