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201668-33-9 | Flufenacet-thioglycolate sulfoxide
CAS No: 201668-33-9 Catalog No: AG01FNZ7 MDL No:
Product Description
Catalog Number:
AG01FNZ7
Chemical Name:
Flufenacet-thioglycolate sulfoxide
CAS Number:
201668-33-9
IUPAC Name:
2-[2-(4-fluoro-N-propan-2-ylanilino)-2-oxoethyl]sulfinylacetic acid
InChI:
InChI=1S/C13H16FNO4S/c1-9(2)15(11-5-3-10(14)4-6-11)12(16)7-20(19)8-13(17)18/h3-6,9H,7-8H2,1-2H3,(H,17,18)
InChI Key:
JCMMUCVPUOXQDO-UHFFFAOYSA-N
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.078g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.332g/mol
Monoisotopic Mass:
301.078g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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