Home Halogens 2,6-Bis(chloromethyl)pyridine

2,6-Bis(chloromethyl)pyridine

CAS No.:
3099-28-3
Catalog Number:
AG0031UY
Molecular Formula:
C7H7Cl2N
Molecular Weight:
176.0432
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$35
- +
5g
98%
In Stock USA
United States
$143
- +
25g
98%
In Stock USA
United States
$575
- +
Product Description
Catalog Number:
AG0031UY
Chemical Name:
2,6-Bis(chloromethyl)pyridine
CAS Number:
3099-28-3
Molecular Formula:
C7H7Cl2N
Molecular Weight:
176.0432
MDL Number:
MFCD00142844
IUPAC Name:
2,6-bis(chloromethyl)pyridine
InChI:
InChI=1S/C7H7Cl2N/c8-4-6-2-1-3-7(5-9)10-6/h1-3H,4-5H2
InChI Key:
IWQNFYRJSVJWQA-UHFFFAOYSA-N
SMILES:
ClCc1cccc(n1)CCl
NSC Number:
244982
Properties
Complexity:
87.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.996g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.04g/mol
Monoisotopic Mass:
174.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Rotational isomers, density functional theory, vibrational spectroscopic studies, thermodynamic functions, NBO and HOMO-LUMO analyses of 2,6-Bis(chloromethyl)pyridine. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101
Synthesis and coordination properties of trifluoromethyl decorated derivatives of 2,6-bis[(diphenylphosphinoyl)methyl]pyridine N-oxide ligands with lanthanide ions. Inorganic chemistry 20090406
Spectroscopic studies on chromium(III), manganese(II), cobalt(II), nickel(II) and copper(II) complexes with hexadentate nitrogen-sulfur donor [N(2)S(4)] macrocyclic ligand. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081201
Secondary interactions in the isomorphous compounds 2,6-bis(chloromethyl)pyridinium chloride and 2,6-bis(bromomethyl)pyridinium bromide. Acta crystallographica. Section C, Crystal structure communications 20040901
A highly selective and sensitive fluorescent chemosensor for Hg2+ in neutral buffer aqueous solution. Journal of the American Chemical Society 20040303
Synthesis and coordination properties of new bis(phosphinomethyl)pyridine N,P,P'-trioxides. Inorganic chemistry 20010813
Properties