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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 3-Bromo-4-methoxybenzonitrile - ≥98%(GC) , CAS No.117572-79-9
Synonyms
Maybridge4_001971 | STR08293 | 3-Bromo-4-methoxylbenzonitrile | CK2129 | 3-Bromo-4-methoxybenzonitrile, 99% | DTXSID20352917 | HMS1526J13 | AKOS000304734 | QHWZMDRKTYTPEE-UHFFFAOYSA-N | W-204949 | 2-Bromo-4-cyanoanisole | MFCD00143097 | 2-Bromo-4-(trifluo
Storage
Protected from light,Room temperature,Argon charged
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Why this grade ≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Protected from light,Room temperature,Argon charged 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.
Panoramica application：
3-Bromo-4-methoxybenzonitrile is used to prepare 3-bromo-2-iodo-4-methoxy-benzonitrile. It is also used as pharmaceutical intermediates
Specifications Sinonimi
Maybridge4_001971 | STR08293 | 3-Bromo-4-methoxylbenzonitrile | CK2129 | 3-Bromo-4-methoxybenzonitrile, 99% | DTXSID20352917 | HMS1526J13 | AKOS000304734 | QHWZMDRKTYTPEE-UHFFFAOYSA-N | W-204949 | 2-Bromo-4-cyanoanisole | MFCD00143097 | 2-Bromo-4-(trifluo
Specifiche e purezza
≥98%(GC)
Condizioni di conservazione di stoccaggio
Protected from light,Room temperature,Argon charged
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488191323
Sorrisi canonici
COC1=C(C=C(C=C1)C#N)Br
IUPAC Name
3-bromo-4-methoxybenzonitrile
InChIKey
QHWZMDRKTYTPEE-UHFFFAOYSA-N
INCHI
1S/C8H6BrNO/c1-11-8-3-2-6(5-10)4-7(8)9/h2-4H,1H3
Isomeri SMILES
COC1=C(C=C(C=C1)C#N)Br
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3246576&ln=
Documentazione 📋 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 Bromobenzenes Alkyl aryl ethers Aryl bromides Nitriles Organopnictogen compounds Organobromides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Anisole - Benzonitrile - Phenol ether - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Ether - Nitrile - Carbonitrile - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound Descrizione 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.
Struttura 3D Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Solubilità Soluble in methanol Sensibilità Sensitive to light and air Punto di fusione (°C) 120-124℃ Peso molecolare 212.040 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 210.963 Da Monoisotopic Mass 210.963 Da Topological Polar Surface Area 33.000 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 174.000 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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