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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Methyl 4-(1H-imidazol-1-yl)benzoate - ≥98% , CAS No.101184-08-1
Synonyms
AKOS005069465 | Methyl 4-(1H-imidazol-1-yl)benzoate, 99% | AMY29165 | J-522220 | KUBBZTZQWIGHFH-UHFFFAOYSA-N | HMS2593K21 | MLS000694657 | methyl 4-imidazol-1-ylbenzoate | Methyl 4-(1-Imidazolyl)benzoate | SMR000332960 | DTXSID00377582 | HMS1364K01 | MFCD
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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 Sinónimos
AKOS005069465 | Methyl 4-(1H-imidazol-1-yl)benzoate, 99% | AMY29165 | J-522220 | KUBBZTZQWIGHFH-UHFFFAOYSA-N | HMS2593K21 | MLS000694657 | methyl 4-imidazol-1-ylbenzoate | Methyl 4-(1-Imidazolyl)benzoate | SMR000332960 | DTXSID00377582 | HMS1364K01 | MFCD
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 504761770 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504761770 Sonrisas canónicas COC(=O)C1=CC=C(C=C1)N2C=CN=C2 IUPAC Name methyl 4-imidazol-1-ylbenzoate InChIKey KUBBZTZQWIGHFH-UHFFFAOYSA-N INCHI 1S/C11H10N2O2/c1-15-11(14)9-2-4-10(5-3-9)13-7-6-12-8-13/h2-8H,1H3 Isómeros SMILES COC(=O)C1=CC=C(C=C1)N2C=CN=C2 WGK Alemania 3 Peso molecular 202.21 Reaxy-Rn 3545793 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3545793&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 Clase Azoles Subclass Imidazoles Intermediate Tree Nodes Substituted imidazoles Direct Parent Phenylimidazoles Alternative Parents Benzoic acid esters Imidazolyl carboxylic acids and derivatives Benzoyl derivatives N-substituted imidazoles Methyl esters Heteroaromatic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents 1-phenylimidazole - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Imidazolyl carboxylic acid derivative - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound Descripción 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.
Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 202.210 g/mol XLogP3 1.500 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 202.074 Da Monoisotopic Mass 202.074 Da Topological Polar Surface Area 44.100 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 225.000 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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