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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 4,6-Dihydroxy-5-nitropyrimidine - ≥98%(T) , CAS No.2164-83-2
Synonyms
6-hydroxy-5-nitropyrimidin-4(3h)-one | 4,6-Dihydroxy-5-nitropyrimdine | AKOS000121443 | 4,6-Pyrimidinediol, 5-nitro-, (keto form) | 5-(4-Nitro-pyrazol-1-ylmethyl)-furan-2-carboxylicacid | SCHEMBL2033648 | InChI=1/C4H3N3O4/c8-3-2(7(10)11)4(9)6-1-5-3/h1H,(H
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Why this grade ≥98%(T) 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 Sinónimos
6-hydroxy-5-nitropyrimidin-4(3h)-one | 4, 6-Dihydroxy-5-nitropyrimdine | AKOS000121443 | 4, 6-Pyrimidinediol, 5-nitro-, (keto form) | 5-(4-Nitro-pyrazol-1-ylmethyl)-furan-2-carboxylicacid | SCHEMBL2033648 | InChI=1/C4H3N3O4/c8-3-2(7(10)11)4(9)6-1-5-3/h1H, (H
Especificaciones y pureza
≥98%(T)
Mecanismos bioquímicos y fisiológicos
It is an inhibitor of thymidine phosphorylase activity. It is also a potent and selective inhibitor of 4-nitrophenol glucuronidation.
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488185037 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488185037 Sonrisas canónicas C1=NC(=C(C(=O)N1)[N+](=O)[O-])O IUPAC Name 4-hydroxy-5-nitro-1H-pyrimidin-6-one InChIKey ABTLZAVJDRUDNG-UHFFFAOYSA-N INCHI 1S/C4H3N3O4/c8-3-2(7(10)11)4(9)6-1-5-3/h1H,(H2,5,6,8,9) Isómeros SMILES C1=NC(=C(C(=O)N1)[N+](=O)[O-])O WGK Alemania 3 Peso molecular 157.09 Beilstein 24(3/4)1193 Reaxy-Rn 1569683 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1569683&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 Organic 1,3-dipolar compounds Clase Allyl-type 1,3-dipolar organic compounds Subclass Organic nitro compounds Intermediate Tree Nodes C-nitro compounds Direct Parent Nitroaromatic compounds Alternative Parents Pyrimidones Hydroxypyrimidines Hydropyrimidines Vinylogous acids Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Nitroaromatic compound - Pyrimidone - Hydroxypyrimidine - Hydropyrimidine - Pyrimidine - Vinylogous acid - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic zwitterion - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de fusión (°C) >300 °C (lit.) Peso molecular 157.080 g/mol XLogP3 -0.300 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 0 Exact Mass 157.012 Da Monoisotopic Mass 157.012 Da Topological Polar Surface Area 108.000 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 274.000 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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