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Home > Fluorides > 1262770-54-6
1262770-54-6 | Nonanoic acid, 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-, 2,5-dioxo-1-pyrrolidinyl ester
CAS No: 1262770-54-6 Catalog No: AG000SGY MDL No:
Product Description
Catalog Number:
AG000SGY
Chemical Name:
Nonanoic acid, 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-, 2,5-dioxo-1-pyrrolidinyl ester
CAS Number:
1262770-54-6
Molecular Formula:
C13H8F13NO4
Molecular Weight:
489.1862
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononanoate
InChI:
InChI=1S/C13H8F13NO4/c14-8(15,4-3-7(30)31-27-5(28)1-2-6(27)29)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h1-4H2
InChI Key:
ATDSDUMFZUDFRA-UHFFFAOYSA-N
SMILES:
O=C(ON1C(=O)CCC1=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Properties
Complexity:
730
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
489.025g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
17
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
489.189g/mol
Monoisotopic Mass:
489.025g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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