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Home > Fluorides > 1443340-82-6
1443340-82-6 | 3-(3-Fluoro-4-methoxyphenyl)thiophenol
CAS No: 1443340-82-6 Catalog No: AG01FCRI MDL No:
Product Description
Catalog Number:
AG01FCRI
Chemical Name:
3-(3-Fluoro-4-methoxyphenyl)thiophenol
CAS Number:
1443340-82-6
Molecular Formula:
C13H11FOS
Molecular Weight:
234.2892
IUPAC Name:
3-(3-fluoro-4-methoxyphenyl)benzenethiol
InChI:
InChI=1S/C13H11FOS/c1-15-13-6-5-10(8-12(13)14)9-3-2-4-11(16)7-9/h2-8,16H,1H3
InChI Key:
LJWIVYAVBMLNEN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)c1cccc(c1)S
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.288g/mol
Monoisotopic Mass:
234.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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