1,1'-Difluoro-2,2'-bipyridinium Bis(tetrafluoroborate) - ≥95% , CAS No.178439-26-4

CAS: 178439-26-4 Cat. No.: D155586 Molecular Weight: 367.79 EC Number: 625-501-7 PubChem CID: 2733931

GRADE & PURITY ≥95%

Synonyms

FT-0629490 | 1,1'-Difluoro-2,2'-bipyridin-1-ium ditetrafluoroborate | N,N/'-DIFLUORO-2,2/'-BIPYRIDINIUM BIS(TETRAFLUOROBORATE) | SCHEMBL63844 | N,N-DIFLUORO-2,2-BIPYRIDINIUMBIS(TETRAFLUOROBORATE) | MFCD01073546 | AKOS008901236 | J-011380 | 1-fluoro-2-(1-f

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

FT-0629490 | 1, 1'-Difluoro-2, 2'-bipyridin-1-ium ditetrafluoroborate | N, N/'-DIFLUORO-2, 2/'-BIPYRIDINIUM BIS(TETRAFLUOROBORATE) | SCHEMBL63844 | N, N-DIFLUORO-2, 2-BIPYRIDINIUMBIS(TETRAFLUOROBORATE) | MFCD01073546 | AKOS008901236 | J-011380 | 1-fluoro-2-(1-f

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488192451
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192451
• Canonical Smiles: [B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=[N+](C(=C1)C2=CC=CC=[N+]2F)F
• IUPAC Name: 1-fluoro-2-(1-fluoropyridin-1-ium-2-yl)pyridin-1-ium;ditetrafluoroborate
• InChIKey: IDFABAACDRPWQX-UHFFFAOYSA-N
• INCHI: 1S/C10H8F2N2.2BF4/c11-13-7-3-1-5-9(13)10-6-2-4-8-14(10)12;2*2-1(3,4)5/h1-8H;;/q+2;2*-1
• Isomeric SMILES: [B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=[N+](C(=C1)C2=CC=CC=[N+]2F)F
• PubChem CID: 2733931
• Molecular Weight: 367.79
• Reaxy-Rn: 8027850

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyridines and derivatives
      • Subclass Bipyridines and oligopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Bipyridines and oligopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Bipyridines and oligopyridines
• Alternative Parents: Pyridinium derivatives Heteroaromatic compounds Organic metalloid salts Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Bipyridine - Pyridinium - Heteroaromatic compound - Azacycle - Organic metalloid salt - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as bipyridines and oligopyridines. These are organic compounds containing two pyridine rings linked to each other.
• 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

Chemical and Physical Properties

• Sensitivity: Air Sensitive,Moisture Sensitive,Heat Sensitive
• Molecular Weight: 367.800 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 1
• Exact Mass: 368.071 Da
• Monoisotopic Mass: 368.071 Da
• Topological Polar Surface Area: 7.800 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 188.000
• 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: 3

XLogP3