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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-(1H-Imidazol-2-yl)benzoic acid - ≥96% , CAS No.108035-45-6
Synonyms
4-(1H-imidazol-2-yl)benzenecarboxylic acid | AMY20302 | AKOS004117837 | AB06030 | FT-0692285 | MLS000735998 | A895368 | F2135-1035 | J-400376 | YJCYHGYOXHANSY-UHFFFAOYSA-N | HMS2651E09 | BB 0260589 | MFCD00456057 | EN300-196266 | DTXSID20363088 | 4G-322S
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Why this grade ≥96% 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
4-(1H-imidazol-2-yl)benzenecarboxylic acid | AMY20302 | AKOS004117837 | AB06030 | FT-0692285 | MLS000735998 | A895368 | F2135-1035 | J-400376 | YJCYHGYOXHANSY-UHFFFAOYSA-N | HMS2651E09 | BB 0260589 | MFCD00456057 | EN300-196266 | DTXSID20363088 | 4G-322S
Specifications & Purity
≥96%
Names and Identifiers Pubchem Sid 488191835 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488191835 Canonical Smiles C1=CC(=CC=C1C2=NC=CN2)C(=O)O IUPAC Name 4-(1H-imidazol-2-yl)benzoic acid InChIKey YJCYHGYOXHANSY-UHFFFAOYSA-N INCHI 1S/C10H8N2O2/c13-10(14)8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H,(H,11,12)(H,13,14) Isomeric SMILES C1=CC(=CC=C1C2=NC=CN2)C(=O)O Molecular Weight 188.2 Reaxy-Rn 3542979 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3542979&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 Benzoic acids Imidazolyl carboxylic acids and derivatives Benzoyl derivatives Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 2-phenylimidazole - Benzoic acid or derivatives - Benzoic acid - Benzoyl - Imidazolyl carboxylic acid derivative - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxylic acid derivative - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - 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 Molecular Weight 188.180 g/mol XLogP3 1.400 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 188.059 Da Monoisotopic Mass 188.059 Da Topological Polar Surface Area 66.000 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 212.000 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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