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· · COA & SDS available for every product · Same-day shipping on in-stock items 5-(4-Nitrophenyl)-1H-pyrazole-3-carboxylic acid - ≥97% , CAS No.189083-63-4
Synonyms
1H-Pyrazole-3-carboxylicacid,5-(4-nitrophenyl)- | DTXSID20377928 | F1967-0139 | EN300-34684 | SCHEMBL15472020 | FT-0701543 | Z204274376 | STK358777 | SCHEMBL874728 | AM20060535 | 1H-Pyrazole-3-carboxylic acid, 5-(4-nitrophenyl)- | AKOS025394483 | 5-(4-nit
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
1H-Pyrazole-3-carboxylicacid, 5-(4-nitrophenyl)- | DTXSID20377928 | F1967-0139 | EN300-34684 | SCHEMBL15472020 | FT-0701543 | Z204274376 | STK358777 | SCHEMBL874728 | AM20060535 | 1H-Pyrazole-3-carboxylic acid, 5-(4-nitrophenyl)- | AKOS025394483 | 5-(4-nit
Specifications & Purity
≥97%
Names and Identifiers Canonical Smiles C1=CC(=CC=C1C2=NNC(=C2)C(=O)O)[N+](=O)[O-] IUPAC Name 3-(4-nitrophenyl)-1H-pyrazole-5-carboxylic acid InChIKey YTCUAJQXEKPQMF-UHFFFAOYSA-N INCHI 1S/C10H7N3O4/c14-10(15)9-5-8(11-12-9)6-1-3-7(4-2-6)13(16)17/h1-5H,(H,11,12)(H,14,15) Isomeric SMILES C1=CC(=CC=C1C2=NNC(=C2)C(=O)O)[N+](=O)[O-] Molecular Weight 233.18 Reaxy-Rn 21599474 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21599474&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Azoles Subclass Pyrazoles Intermediate Tree Nodes Not available Direct Parent Phenylpyrazoles Alternative Parents Nitrobenzenes Pyrazole carboxylic acids and derivatives Nitroaromatic compounds Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Phenylpyrazole - Nitrobenzene - Nitroaromatic compound - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 233.180 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 2 Exact Mass 233.044 Da Monoisotopic Mass 233.044 Da Topological Polar Surface Area 112.000 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 309.000 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
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