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Home > Fluorides > 1368394-42-6
1368394-42-6 | 8-Quinolinecarbonitrile, 6-fluoro-
CAS No: 1368394-42-6 Catalog No: AG0012FX MDL No:
Product Description
Catalog Number:
AG0012FX
Chemical Name:
8-Quinolinecarbonitrile, 6-fluoro-
CAS Number:
1368394-42-6
Molecular Formula:
C10H5FN2
Molecular Weight:
172.1585
IUPAC Name:
6-fluoroquinoline-8-carbonitrile
InChI:
InChI=1S/C10H5FN2/c11-9-4-7-2-1-3-13-10(7)8(5-9)6-12/h1-5H
InChI Key:
JRMBUELLJPLSTO-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)cc2c1nccc2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.044g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.162g/mol
Monoisotopic Mass:
172.044g/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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