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Home > Fluorides > 1443311-18-9
1443311-18-9 | 4-Oxo-4-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]butyric acid
CAS No: 1443311-18-9 Catalog No: AG01F7BZ MDL No:
Product Description
Catalog Number:
AG01F7BZ
Chemical Name:
4-Oxo-4-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]butyric acid
CAS Number:
1443311-18-9
Molecular Formula:
C12H10F4O4
Molecular Weight:
294.1990
IUPAC Name:
4-oxo-4-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]butanoic acid
InChI:
InChI=1S/C12H10F4O4/c13-11(14)12(15,16)20-8-3-1-2-7(6-8)9(17)4-5-10(18)19/h1-3,6,11H,4-5H2,(H,18,19)
InChI Key:
OYQFSYZTMZLIQT-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(=O)c1cccc(c1)OC(C(F)F)(F)F
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.052g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.202g/mol
Monoisotopic Mass:
294.052g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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