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Home > Fluorides > 1443306-62-4
1443306-62-4 | 3-(4-Fluoro-3-methylphenyl)thiophenol
CAS No: 1443306-62-4 Catalog No: AG01FD4I MDL No:
Product Description
Catalog Number:
AG01FD4I
Chemical Name:
3-(4-Fluoro-3-methylphenyl)thiophenol
CAS Number:
1443306-62-4
Molecular Formula:
C13H11FS
Molecular Weight:
218.2898
IUPAC Name:
3-(4-fluoro-3-methylphenyl)benzenethiol
InChI:
InChI=1S/C13H11FS/c1-9-7-11(5-6-13(9)14)10-3-2-4-12(15)8-10/h2-8,15H,1H3
InChI Key:
LWFKXTILHQAMBY-UHFFFAOYSA-N
SMILES:
Sc1cccc(c1)c1ccc(c(c1)C)F
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.057g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.289g/mol
Monoisotopic Mass:
218.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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