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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 3-Cyanomethylphenylboronic acid - ≥97% , CAS No.220616-39-7
Synonyms
BDBM50266940 | Boronic acid, [3-(cyanomethyl)phenyl]- | PS-9429 | (3-(Cyanomethyl)phenyl)boronic acid | FT-0644036 | JFMYJQMAPRBDFF-UHFFFAOYSA-N | 3-(Cyanomethyl)benzeneboronic acid | DTXSID00378392 | (3-(Cyanomethyl)phenyl)boronicacid | 3-Cyanomethylphen
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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 Sinónimos
BDBM50266940 | Boronic acid, [3-(cyanomethyl)phenyl]- | PS-9429 | (3-(Cyanomethyl)phenyl)boronic acid | FT-0644036 | JFMYJQMAPRBDFF-UHFFFAOYSA-N | 3-(Cyanomethyl)benzeneboronic acid | DTXSID00378392 | (3-(Cyanomethyl)phenyl)boronicacid | 3-Cyanomethylphen
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas B(C1=CC(=CC=C1)CC#N)(O)O IUPAC Name [3-(cyanomethyl)phenyl]boronic acid InChIKey JFMYJQMAPRBDFF-UHFFFAOYSA-N INCHI 1S/C8H8BNO2/c10-5-4-7-2-1-3-8(6-7)9(11)12/h1-3,6,11-12H,4H2 Isómeros SMILES B(C1=CC(=CC=C1)CC#N)(O)O Peso molecular 160.97 Reaxy-Rn 9257986 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9257986&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 Clase Benzene and substituted derivatives Subclass Benzyl cyanides Intermediate Tree Nodes Not available Direct Parent Benzyl cyanides Alternative Parents Boronic acids Organic metalloid salts Nitriles Organopnictogen compounds Organoboron compounds Organic oxygen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Benzyl-cyanide - Boronic acid - Boronic acid derivative - Organic metalloid salt - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organoboron compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as benzyl cyanides. These are organic compounds containing an acetonitrile with one hydrogen replaced by 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.
Estructura 3D Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 160.970 g/mol XLogP3 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 161.065 Da Monoisotopic Mass 161.065 Da Topological Polar Surface Area 64.300 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 187.000 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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