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· · COA & SDS Disponível para todos os produtos · Envio no mesmo dia em itens em estoque 3-Methoxybenzonitrile - ≥98% , CAS No.1527-89-5
Disponível para encomenda
Synonyms
EINECS 216-201-3 | A21196 | 3-METHOXYBENZONITRILE | M1291 | FT-0615990 | MFCD00001801 | m-Cyanoanisole | 3-anisonitrile | 3-methoxy benzonitrile | M-Methoxybenzonitrile;Benzonitrile, 3-methoxy-;Benzonitrile, m-methoxy- | UY5E89BBS6 | Benzonitrile, m-metho
Storage
Protected from light,Room temperature
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Protected from light,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.
Visão geral 3-Methoxybenzonitrile undergoes dealkylation on treatment with SiCl4/LiI and BF3.
application：
3-Methoxybenzonitrile has been used in the synthesis of new organic pigments which were evaluated as the active medium of the solid-state dye laser.
Specifications Sinónimos
EINECS 216-201-3 | A21196 | 3-METHOXYBENZONITRILE | M1291 | FT-0615990 | MFCD00001801 | m-Cyanoanisole | 3-anisonitrile | 3-methoxy benzonitrile | M-Methoxybenzonitrile;Benzonitrile, 3-methoxy-;Benzonitrile, m-methoxy- | UY5E89BBS6 | Benzonitrile, m-metho
Especificações e pureza
≥98%
Condições de armazenamento de armazenamento
Protected from light,Room temperature
Nomes e identificadores Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488184792
Sorrisos canónicos
COC1=CC=CC(=C1)C#N
IUPAC Name
3-methoxybenzonitrile
InChIKey
KLXSUMLEPNAZFK-UHFFFAOYSA-N
INCHI
1S/C8H7NO/c1-10-8-4-2-3-7(5-8)6-9/h2-5H,1H3
SMILES isoméricas
COC1=CC=CC(=C1)C#N
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1932666&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 Benzenoids Classe Benzene and substituted derivatives Subclass Benzonitriles Intermediate Tree Nodes Not available Direct Parent Benzonitriles Alternative Parents Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Nitriles Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Phenoxy compound - Anisole - Benzonitrile - Methoxybenzene - Phenol ether - Alkyl aryl ether - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound Descrição This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent. 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 Solubilidade Slightly soluble in water; Very soluble in Ethanol,Ether Sensibilidade Light sensitive. Índice de refração 1.54 Ponto de inflamação (°F) 221 °F Ponto de inflamação (°C) 105 °C Ponto de ebulição (°C) 140°C/34mmHg Ponto de fusão (°C) 283°C Peso molecular 133.150 g/mol XLogP3 1.400 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 133.053 Da Monoisotopic Mass 133.053 Da Topological Polar Surface Area 33.000 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 147.000 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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