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· · COA & SDS Disponível para todos os produtos · Envio no mesmo dia em itens em estoque 2-Acetyl-isonicotinic acid methyl ester - ≥98% , CAS No.138715-82-9
Disponível para encomenda
Synonyms
DS-4633 | EN300-7359827 | J-400984 | SB52344 | FT-0736085 | DTXSID20468860 | 2-acetylisonicotinic acid methyl ester | 2-ACETYL-ISONICOTINIC ACID METHYL ESTER | METHYL 2-ACETYLISONICOTINATE | methyl-2-acetylisonicotinate | Methyl2-acetylisonicotinate | SCH
Storage
Room temperature,Argon charged,Desiccated
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged,Desiccated 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
DS-4633 | EN300-7359827 | J-400984 | SB52344 | FT-0736085 | DTXSID20468860 | 2-acetylisonicotinic acid methyl ester | 2-ACETYL-ISONICOTINIC ACID METHYL ESTER | METHYL 2-ACETYLISONICOTINATE | methyl-2-acetylisonicotinate | Methyl2-acetylisonicotinate | SCH
Especificações e pureza
≥98%
Condições de armazenamento de armazenamento
Room temperature,Argon charged,Desiccated
Nomes e identificadores Sorrisos canónicos
CC(=O)C1=NC=CC(=C1)C(=O)OC
IUPAC Name
methyl 2-acetylpyridine-4-carboxylate
InChIKey
VKPFTQQVEGRJCF-UHFFFAOYSA-N
INCHI
1S/C9H9NO3/c1-6(11)8-5-7(3-4-10-8)9(12)13-2/h3-5H,1-2H3
SMILES isoméricas
CC(=O)C1=NC=CC(=C1)C(=O)OC
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10246482&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 Classe Pyridines and derivatives Subclass Pyridinecarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Pyridinecarboxylic acids Alternative Parents Aryl alkyl ketones Methyl esters Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Pyridine carboxylic acid - Aryl alkyl ketone - Aryl ketone - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound Descrição This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid 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.
Estrutura 3D Certificados（CoA,COO,BSE/TSE e Mapa de Análise) Propriedades químicas e físicas Peso molecular 179.170 g/mol XLogP3 0.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 179.058 Da Monoisotopic Mass 179.058 Da Topological Polar Surface Area 56.300 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 215.000 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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