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Home > Fluorides > 140483-60-9
140483-60-9 | [1,1'-Biphenyl]-4-carbonitrile, 4'-(trifluoromethyl)-
CAS No: 140483-60-9 Catalog No: AG001CIT MDL No:MFCD06801991
Product Description
Catalog Number:
AG001CIT
Chemical Name:
[1,1'-Biphenyl]-4-carbonitrile, 4'-(trifluoromethyl)-
CAS Number:
140483-60-9
Molecular Formula:
C14H8F3N
Molecular Weight:
247.2152
MDL Number:
MFCD06801991
IUPAC Name:
4-[4-(trifluoromethyl)phenyl]benzonitrile
InChI:
InChI=1S/C14H8F3N/c15-14(16,17)13-7-5-12(6-8-13)11-3-1-10(9-18)2-4-11/h1-8H
InChI Key:
NHEWFAFOFOSWGG-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.22g/mol
Monoisotopic Mass:
247.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Bis(hetero)aryl derivatives as unique kinesin spindle protein inhibitors. | Bioorganic & medicinal chemistry letters 20090215 |
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