4-(4-bromophenyl)-1H-1,2,3-triazole , CAS No.5301-98-4

CAS: 5301-98-4 Cat. No.: B668962 Peso molecular: 224.06
Disponible para pedir
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
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1mg
B668962-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

571,90US$

999,90US$
Guardar 428,00 US$ (42.80%)
5mg
B668962-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

1.999,90US$

2.999,90US$
Guardar 1.000,00 US$ (33.33%)
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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

Sinónimos
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
Condiciones de almacenamiento de almacenamiento
Room temperature
Tipo de acción
INHIBITOR
Propiedades del producto
ALogP1.9
Nombres e identificadores
Sonrisas canónicasC1=CC(=CC=C1C2=NNN=C2)Br
IUPAC Name4-(4-bromophenyl)-2H-triazole
InChIKeyRYKZCPFWGNDOQV-UHFFFAOYSA-N
INCHI1S/C8H6BrN3/c9-7-3-1-6(2-4-7)8-5-10-12-11-8/h1-5H,(H,10,11,12)
Isómeros SMILES C1=CC(=CC=C1C2=NNN=C2)Br
Peso molecular 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

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseAzoles
SubclassTriazoles
Intermediate Tree Nodes Phenyltriazoles
Direct ParentPhenyl-1,2,3-triazoles
Alternative Parents Bromobenzenes  Aryl bromides  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic 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
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
METAP2 Tchem Methionine aminopeptidase 2 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
METAP2 Tchem Methionine aminopeptidase 2 (1512 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HUVEC (11049 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
Peso molecular224.060 g/mol
XLogP31.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass222.975 Da
Monoisotopic Mass222.975 Da
Topological Polar Surface Area41.600 Ų
Heavy Atom Count12
Formal Charge0
Complexity145.000
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
Calculadoras de soluciones
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