diethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanedioate


Chemical Name: diethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanedioate
CAS Number: 172527-71-8
Product Number: AG00AZG5(AGN-PC-0KKVVF)
Synonyms:
MDL No:
Molecular Formula: C13H13ClF3NO4
Molecular Weight: 339.6948

Identification/Properties


Computed Properties
Molecular Weight:
339.695g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
339.049g/mol
Monoisotopic Mass:
339.049g/mol
Topological Polar Surface Area:
65.5A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
387
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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