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Home > Fluorides > 116508-55-5
116508-55-5 | 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrafluoro-2-(1-methylethyl)-
CAS No: 116508-55-5 Catalog No: AG000COE MDL No:
Product Description
Catalog Number:
AG000COE
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrafluoro-2-(1-methylethyl)-
CAS Number:
116508-55-5
Molecular Formula:
C11H7F4NO2
Molecular Weight:
261.1724
IUPAC Name:
4,5,6,7-tetrafluoro-2-propan-2-ylisoindole-1,3-dione
InChI:
InChI=1S/C11H7F4NO2/c1-3(2)16-10(17)4-5(11(16)18)7(13)9(15)8(14)6(4)12/h3H,1-2H3
InChI Key:
HRECWOSIKPDLLL-UHFFFAOYSA-N
SMILES:
CC(N1C(=O)c2c(C1=O)c(F)c(c(c2F)F)F)C
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.041g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.176g/mol
Monoisotopic Mass:
261.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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