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Home > Fluorides > 1443311-53-2
1443311-53-2 | 3-(1,1,2,2-Tetrafluoroethoxy)thiophenol
CAS No: 1443311-53-2 Catalog No: AG01FCDR MDL No:
Product Description
Catalog Number:
AG01FCDR
Chemical Name:
3-(1,1,2,2-Tetrafluoroethoxy)thiophenol
CAS Number:
1443311-53-2
Molecular Formula:
C8H6F4OS
Molecular Weight:
226.1913
IUPAC Name:
3-(1,1,2,2-tetrafluoroethoxy)benzenethiol
InChI:
InChI=1S/C8H6F4OS/c9-7(10)8(11,12)13-5-2-1-3-6(14)4-5/h1-4,7,14H
InChI Key:
JWDGLNYZRKYJKJ-UHFFFAOYSA-N
SMILES:
Sc1cccc(c1)OC(C(F)F)(F)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.008g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.189g/mol
Monoisotopic Mass:
226.008g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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