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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-(1H-Imidazol-1-yl)aniline - ≥98% , CAS No.2221-00-3
Synonyms
Maybridge3_005125 | W-201923 | A816017 | J-640088 | NSC 266462 | SMR000033673 | 4-imidazol-1-ylaniline;4-(1H-Imidazol-1-yl)aniline | HMS1445I21 | [4-(1H-imidazol-1-yl)phenyl]amine | EN300-28522 | NSC266462 | NSC-266462 | 4-(1H-Imidazol-1-yl)aniline, 98% |
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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 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 Synonyms
Maybridge3_005125 | W-201923 | A816017 | J-640088 | NSC 266462 | SMR000033673 | 4-imidazol-1-ylaniline;4-(1H-Imidazol-1-yl)aniline | HMS1445I21 | [4-(1H-imidazol-1-yl)phenyl]amine | EN300-28522 | NSC266462 | NSC-266462 | 4-(1H-Imidazol-1-yl)aniline, 98% |
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488189487 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488189487 Canonical Smiles C1=CC(=CC=C1N)N2C=CN=C2 IUPAC Name 4-imidazol-1-ylaniline InChIKey LVOASPZGXNAHJI-UHFFFAOYSA-N INCHI 1S/C9H9N3/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h1-7H,10H2 Isomeric SMILES C1=CC(=CC=C1N)N2C=CN=C2 WGK Germany 3 Molecular Weight 159.19 Reaxy-Rn 607776 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=607776&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 Imidazoles Intermediate Tree Nodes Substituted imidazoles Direct Parent Phenylimidazoles Alternative Parents Aniline and substituted anilines N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 1-phenylimidazole - Aniline or substituted anilines - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond. 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) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 143-147 °C (lit.) Molecular Weight 159.190 g/mol XLogP3 1.000 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 159.08 Da Monoisotopic Mass 159.08 Da Topological Polar Surface Area 43.800 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 141.000 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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