1-(3-chlorophenyl)imidazole - Reagent grade , CAS No.51581-52-3

CAS: 51581-52-3 Cat. No.: C479133 Peso molecular: 178.62 Número EC: 674-016-7
Disponible para pedir
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required.
Synonyms
FS-1537 | BRN 0510023 | SCHEMBL710352 | 1H-Imidazole, 1-(3-chlorophenyl)- | 1-(3-Chlorophenyl)-1H-imidazole | 5-23-04-00268 (Beilstein Handbook Reference) | BDBM50575448 | Imidazole, 1-(m-chlorophenyl)- | MFCD00041207 | NSC 220073 | NSC220073 | NSC-220073
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
100mg
C479133-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

130,90US$

153,90US$
Guardar 23,00 US$ (14.94%)
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Why this grade

Reagent grade Reagent 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

Sinónimos
FS-1537 | BRN 0510023 | SCHEMBL710352 | 1H-Imidazole, 1-(3-chlorophenyl)- | 1-(3-Chlorophenyl)-1H-imidazole | 5-23-04-00268 (Beilstein Handbook Reference) | BDBM50575448 | Imidazole, 1-(m-chlorophenyl)- | MFCD00041207 | NSC 220073 | NSC220073 | NSC-220073
Especificaciones y pureza
Reagent grade
Condiciones de almacenamiento de almacenamiento
Room temperature
Grado
Reagent Grade
Nombres e identificadores
Sonrisas canónicasC1=CC(=CC(=C1)Cl)N2C=CN=C2
IUPAC Name1-(3-chlorophenyl)imidazole
InChIKeyLEKTXVRARNYCNV-UHFFFAOYSA-N
INCHI1S/C9H7ClN2/c10-8-2-1-3-9(6-8)12-5-4-11-7-12/h1-7H
Isómeros SMILES C1=CC(=CC(=C1)Cl)N2C=CN=C2
Peso molecular 178.62
Reaxy-Rn 510023
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=510023&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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseAzoles
SubclassImidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct ParentPhenylimidazoles
Alternative Parents Chlorobenzenes  N-substituted imidazoles  Aryl chlorides  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 1-phenylimidazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Azacycle - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteromonocyclic compound
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
IDO1 Tchem Indoleamine 2,3-dioxygenase (6650 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
PTR1 Pteridine reductase 1 (345 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Punto de ebullición (°C)145/1mm
Peso molecular178.620 g/mol
XLogP32.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass178.03 Da
Monoisotopic Mass178.03 Da
Topological Polar Surface Area17.800 Ų
Heavy Atom Count12
Formal Charge0
Complexity151.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Calculadoras de soluciones
Reseñas

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