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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-(4-bromophenyl)-1H-1,2,3-triazole , CAS No.5301-98-4
Synonyms
4-(4-bromophenyl)-1H-1,2,3-triazole | MetAP2-IN-1 | 5-(4-bromophenyl)-1H-1,2,3-triazole | 1H-1,2,3-Triazole, 4-(4-bromophenyl)- | 4-(4-bromophenyl)-2H-triazole | p-bromophenyl triazol | BDBM17460 | DTXSID10423549 | RYKZCPFWGNDOQV-UHFFFAOYSA-N | AKOS023565
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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 Synonyms
4-(4-bromophenyl)-1H-1, 2, 3-triazole | MetAP2-IN-1 | 5-(4-bromophenyl)-1H-1, 2, 3-triazole | 1H-1, 2, 3-Triazole, 4-(4-bromophenyl)- | 4-(4-bromophenyl)-2H-triazole | p-bromophenyl triazol | BDBM17460 | DTXSID10423549 | RYKZCPFWGNDOQV-UHFFFAOYSA-N | AKOS023565
Product Properties Names and Identifiers Canonical Smiles C1=CC(=CC=C1C2=NNN=C2)Br IUPAC Name 4-(4-bromophenyl)-2H-triazole InChIKey RYKZCPFWGNDOQV-UHFFFAOYSA-N INCHI 1S/C8H6BrN3/c9-7-3-1-6(2-4-7)8-5-10-12-11-8/h1-5H,(H,10,11,12) Isomeric SMILES C1=CC(=CC=C1C2=NNN=C2)Br Molecular Weight 224.06 Reaxy-Rn 608544 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=608544&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 Class Azoles Subclass Triazoles Intermediate Tree Nodes Phenyltriazoles Direct Parent Phenyl-1,2,3-triazoles Alternative Parents Bromobenzenes Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Phenyl-1,2,3-triazole - Halobenzene - Bromobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as phenyl-1,2,3-triazoles. These are organic compounds containing a 1,2,3-triazole substituted 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.
3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 224.060 g/mol XLogP3 1.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 222.975 Da Monoisotopic Mass 222.975 Da Topological Polar Surface Area 41.600 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 145.000 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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