3-Ethynyl-5-fluoropyridine - ≥97% , CAS No.872122-54-8

CAS: 872122-54-8 Cat. No.: E1052999 Fórmula: C7H4FN Peso molecular: 121.11 Número EC: 831-458-7 PubChem CID: 56972359
Disponible para pedir
GRADE & PURITY ≥97%
Storage
Room temperature
★
Size
Alemania (EU)
USA*
Price
Qty
100mg
E1052999-100mg
Fabricado bajo pedido · 8–12 semanas
73,67€
250mg
E1052999-250mg
Fabricado bajo pedido · 8–12 semanas
121,40€
1g
E1052999-1g
Fabricado bajo pedido · 8–12 semanas
259,37€
5g
E1052999-5g
Fabricado bajo pedido · 8–12 semanas
976,12€
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasC#CC1=CC(=CN=C1)F
IUPAC Name3-ethynyl-5-fluoropyridine
InChIKeyHICJXFHZGYLFJQ-UHFFFAOYSA-N
INCHI1S/C7H4FN/c1-2-6-3-7(8)5-9-4-6/h1,3-5H
Isómeros SMILES C#CC1=CC(=CN=C1)F
PubChem CID 56972359
Peso molecular 121.11

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
ClasePyridines and derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPyridines and derivatives
Alternative Parents Aryl fluorides  Heteroaromatic compounds  Azacyclic compounds  Acetylides  Organonitrogen compounds  Organofluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Pyridine - Aryl halide - Aryl fluoride - Heteroaromatic compound - Acetylide - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular121.110 g/mol
XLogP31.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass121.033 Da
Monoisotopic Mass121.033 Da
Topological Polar Surface Area12.900 Ų
Heavy Atom Count9
Formal Charge0
Complexity135.000
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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Preguntas frecuentes

What is the purity of this product?
This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at room temperature.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 872122-54-8, the molecular formula is C7H4FN, and the molecular weight is 121.11 g/mol. InChIKey HICJXFHZGYLFJQ-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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