Taxonomic Classification

Taxonomy Tree

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Halopyridines
Intermediate Tree Nodes	Not available
Direct Parent	Polyhalopyridines
Alternative Parents	2-halopyridines Metal aryls Aryl fluorides Aryl chlorides Heteroaromatic compounds Trialkyltins Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Polyhalopyridine - 2-halopyridine - Aryl chloride - Metal aryl - Aryl fluoride - Aryl halide - Heteroaromatic compound - Trialkyltin - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organometallic compound - Organofluoride - Organochloride - Organic post-transition metal moeity - Organohalogen compound - Organotin compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description	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
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

3D Structure

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
J2114216	Certificate of Analysis	Jul 08, 2024	C184369
J2114217	Certificate of Analysis	Jul 08, 2024	C184369
J2114218	Certificate of Analysis	Jul 08, 2024	C184369
J2114219	Certificate of Analysis	Jul 08, 2024	C184369
L2419305	Certificate of Analysis	Jul 08, 2024	C184369
F2414020	Certificate of Analysis	Sep 13, 2021	C184369

Chemical and Physical Properties

Molecular Weight	420.600 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	10
Exact Mass	421.099 Da
Monoisotopic Mass	421.099 Da
Topological Polar Surface Area	12.900 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	256.000
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	1

Solution Calculators

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Reviews

Pubchem Sid	488201375
Canonical Smiles	CCCC[Sn](CCCC)(CCCC)C1=CC(=C(N=C1)Cl)F
IUPAC Name	tributyl-(6-chloro-5-fluoropyridin-3-yl)stannane
InChIKey	RVWINZZAKLQMEB-UHFFFAOYSA-N
INCHI	1S/C5H2ClFN.3C4H9.Sn/c6-5-4(7)2-1-3-8-5;31-3-4-2;/h2-3H;31,3-4H2,2H3;
Isomeric SMILES	CCCC[Sn](CCCC)(CCCC)C1=CC(=C(N=C1)Cl)F
PubChem CID	46839941
Molecular Weight	420.6

2-Chloro-3-fluoro-5-(tributylstannyl)pyridine - ≥90% , CAS No.405556-97-0

Specifications