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Home > Fluorides > 259544-93-9
259544-93-9 | 3-(4-Fluorophenylthio)butyric acid
CAS No: 259544-93-9 Catalog No: AG01FGDH MDL No:
Product Description
Catalog Number:
AG01FGDH
Chemical Name:
3-(4-Fluorophenylthio)butyric acid
CAS Number:
259544-93-9
IUPAC Name:
3-(4-fluorophenyl)sulfanylbutanoic acid
InChI:
InChI=1S/C10H11FO2S/c1-7(6-10(12)13)14-9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)
InChI Key:
QLYYIOYEODVXCF-UHFFFAOYSA-N
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.254g/mol
Monoisotopic Mass:
214.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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