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Home > Fluorides > 116508-58-8
116508-58-8 | 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrafluoro-2-phenyl-
CAS No: 116508-58-8 Catalog No: AG000COD MDL No:
Product Description
Catalog Number:
AG000COD
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrafluoro-2-phenyl-
CAS Number:
116508-58-8
Molecular Formula:
C14H5F4NO2
Molecular Weight:
295.1886
IUPAC Name:
4,5,6,7-tetrafluoro-2-phenylisoindole-1,3-dione
InChI:
InChI=1S/C14H5F4NO2/c15-9-7-8(10(16)12(18)11(9)17)14(21)19(13(7)20)6-4-2-1-3-5-6/h1-5H
InChI Key:
NIPHRIDFYCSLRP-UHFFFAOYSA-N
SMILES:
O=C1N(c2ccccc2)C(=O)c2c1c(F)c(c(c2F)F)F
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.026g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.193g/mol
Monoisotopic Mass:
295.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Tubulin polymerization inhibitors with a fluorinated phthalimide skeleton derived from thalidomide. | Bioorganic & medicinal chemistry letters 20060915 |
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