2-Pyridineacetonitrile, 3-chloro-5-(trifluoromethyl)-


Chemical Name: 2-Pyridineacetonitrile, 3-chloro-5-(trifluoromethyl)-
CAS Number: 157764-10-8
Product Number: AG001POA(AGN-PC-00UXD8)
Synonyms:
MDL No:
Molecular Formula: C8H4ClF3N2
Molecular Weight: 220.5790

Identification/Properties


Computed Properties
Molecular Weight:
220.579g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
220.002g/mol
Monoisotopic Mass:
220.002g/mol
Topological Polar Surface Area:
36.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
245
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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