Determine the necessary mass, volume, or concentration for preparing a solution.
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≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488185545 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488185545 |
| Canonical Smiles | C1=CC=C2C(=C1)C(=NN2)C(=O)O |
| IUPAC Name | 1H-indazole-3-carboxylic acid |
| InChIKey | BHXVYTQDWMQVBI-UHFFFAOYSA-N |
| INCHI | 1S/C8H6N2O2/c11-8(12)7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H,9,10)(H,11,12) |
| Isomeric SMILES | C1=CC=C2C(=C1)C(=NN2)C(=O)O |
| WGK Germany | 3 |
| Molecular Weight | 162.15 |
| Beilstein | 6354 |
| Reaxy-Rn | 6354 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6354&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Benzopyrazoles |
| Subclass | Indazoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indazoles |
| Alternative Parents | Pyrazole carboxylic acids and derivatives Benzenoids Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzopyrazole - Indazole - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Benzenoid - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Feb 08, 2025 | I157584 | |
| Certificate of Analysis | Mar 21, 2024 | I157584 | |
| Certificate of Analysis | Mar 21, 2024 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Jul 14, 2023 | I157584 | |
| Certificate of Analysis | Oct 13, 2022 | I157584 | |
| Certificate of Analysis | Oct 13, 2022 | I157584 | |
| Certificate of Analysis | Oct 13, 2022 | I157584 |
| Solubility | Soluble in Dimethylformamide |
|---|---|
| Melt Point(°C) | 266-270°C |
| Molecular Weight | 162.150 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 162.043 Da |
| Monoisotopic Mass | 162.043 Da |
| Topological Polar Surface Area | 66.000 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 195.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |