Home Halogens Ethyl 4,5,6-trichloronicotinate

Ethyl 4,5,6-trichloronicotinate

CAS No.:
181261-73-4
Catalog Number:
AG00AKGY
Molecular Formula:
C8H6Cl3NO2
Molecular Weight:
254.4977
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$404
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Product Description
Catalog Number:
AG00AKGY
Chemical Name:
Ethyl 4,5,6-trichloronicotinate
CAS Number:
181261-73-4
Molecular Formula:
C8H6Cl3NO2
Molecular Weight:
254.4977
MDL Number:
MFCD03695822
IUPAC Name:
ethyl 4,5,6-trichloropyridine-3-carboxylate
InChI:
InChI=1S/C8H6Cl3NO2/c1-2-14-8(13)4-3-12-7(11)6(10)5(4)9/h3H,2H2,1H3
InChI Key:
XWJXULFLZWQHML-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc(c(c1Cl)Cl)Cl
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.946g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.491g/mol
Monoisotopic Mass:
252.946g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties