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Home > Fluorides > 1214383-56-8
1214383-56-8 | 4-Pyridinecarbonitrile, 3-(trifluoromethyl)-
CAS No: 1214383-56-8 Catalog No: AG0014YR MDL No:
Product Description
Catalog Number:
AG0014YR
Chemical Name:
4-Pyridinecarbonitrile, 3-(trifluoromethyl)-
CAS Number:
1214383-56-8
Molecular Formula:
C7H3F3N2
Molecular Weight:
172.1073
IUPAC Name:
3-(trifluoromethyl)pyridine-4-carbonitrile
InChI:
InChI=1S/C7H3F3N2/c8-7(9,10)6-4-12-2-1-5(6)3-11/h1-2,4H
InChI Key:
XDFMPLZEHJZSPJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccncc1C(F)(F)F
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.11g/mol
Monoisotopic Mass:
172.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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