3-Pyridinecarbonitrile, 2-(trifluoromethyl)-


Chemical Name: 3-Pyridinecarbonitrile, 2-(trifluoromethyl)-
CAS Number: 870066-15-2
Product Number: AG003F5V(AGN-PC-058CRT)
Synonyms:
MDL No:
Molecular Formula: C7H3F3N2
Molecular Weight: 172.1073

Identification/Properties


Properties
BP:
208.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
172.11g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
172.025g/mol
Monoisotopic Mass:
172.025g/mol
Topological Polar Surface Area:
36.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
202
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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