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28122-13-6 | 2-[(4-Fluorophenyl)sulfonyl]ethanol
CAS No: 28122-13-6 Catalog No: AG01EUO6 MDL No:MFCD03789137
Product Description
Catalog Number:
AG01EUO6
Chemical Name:
2-[(4-Fluorophenyl)sulfonyl]ethanol
CAS Number:
28122-13-6
Molecular Formula:
C8H9FO3S
Molecular Weight:
204.2187
MDL Number:
MFCD03789137
IUPAC Name:
2-(4-fluorophenyl)sulfonylethanol
InChI:
InChI=1S/C8H9FO3S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4,10H,5-6H2
InChI Key:
BUQOMEFZYUQRIV-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)c1ccc(cc1)F
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.026g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.215g/mol
Monoisotopic Mass:
204.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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