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Home > Fluorides > 151025-70-6
151025-70-6 | 4-Quinolinecarbonitrile, 2,8-bis(trifluoromethyl)-
CAS No: 151025-70-6 Catalog No: AG001N15 MDL No:
Product Description
Catalog Number:
AG001N15
Chemical Name:
4-Quinolinecarbonitrile, 2,8-bis(trifluoromethyl)-
CAS Number:
151025-70-6
Molecular Formula:
C12H4F6N2
Molecular Weight:
290.1640
IUPAC Name:
2,8-bis(trifluoromethyl)quinoline-4-carbonitrile
InChI:
InChI=1S/C12H4F6N2/c13-11(14,15)8-3-1-2-7-6(5-19)4-9(12(16,17)18)20-10(7)8/h1-4H
InChI Key:
USLFWXIBZJRLCE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(nc2c1cccc2C(F)(F)F)C(F)(F)F
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.028g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.168g/mol
Monoisotopic Mass:
290.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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