3,5-Difluoropyridine - ≥98% , CAS No.71902-33-5

CAS: 71902-33-5 Cat. No.: D186227 Fórmula: C₅H₃F₂N Peso molecular: 115.1 Número CE: 624-636-9

GRADE & PURITY ≥98%

Synonyms

InChI=1/C5H3F2N/c6-4-1-5(7)3-8-2-4/h1-3 | SCHEMBL56635 | WRXAZPPGFLETFR-UHFFFAOYSA-N | GEO-03900 | 3,5-Difluoropyridine, 97% | DTXSID70349074 | BP-11397 | AB14383 | PS-9234 | EN300-96529 | J-511333 | MFCD03412222 | pyridine, 3,5-difluoro- | D4038 | FT-061

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

InChI=1/C5H3F2N/c6-4-1-5(7)3-8-2-4/h1-3 | SCHEMBL56635 | WRXAZPPGFLETFR-UHFFFAOYSA-N | GEO-03900 | 3,5-Difluoropyridine, 97% | DTXSID70349074 | BP-11397 | AB14383 | PS-9234 | EN300-96529 | J-511333 | MFCD03412222 | pyridine, 3,5-difluoro- | D4038 | FT-061

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Argon charged,Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488190944

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190944

Sorrisos canónicos

C1=C(C=NC=C1F)F

IUPAC Name

3,5-difluoropyridine

InChIKey

WRXAZPPGFLETFR-UHFFFAOYSA-N

INCHI

1S/C5H3F2N/c6-4-1-5(7)3-8-2-4/h1-3H

SMILES isoméricas

C1=C(C=NC=C1F)F

WGK Alemanha

3

Número UN

1993

Grupo de embalagem

II

Peso molecular

115.1

Reaxy-Rn

7914363

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7914363&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Halopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: Aryl fluorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - Aryl halide - Aryl fluoride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by a halogen atom.
• 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.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Sensibilidade: Air sensitive
• Índice de refração: 1.4437
• Ponto de inflamação (°F): 48 °F
• Ponto de inflamação (°C): 9°C
• Ponto de ebulição (°C): 92-93℃
• Peso molecular: 115.080 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 115.023 Da
• Monoisotopic Mass: 115.023 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 68.800
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 71902-33-5, the molecular formula is C5H3F2N, and the molecular weight is 115.1 g/mol. InChIKey WRXAZPPGFLETFR-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.