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Home Sulfos 1-Phenyl-2-(phenylsulfonyl)ethanone

1-Phenyl-2-(phenylsulfonyl)ethanone

CAS No.:
3406-03-9
Catalog Number:
AG003F41
Molecular Formula:
C14H12O3S
Molecular Weight:
260.3083
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
99%
1 week
United States
$52
- +
5g
99%
1 week
United States
$73
- +
25g
99%
1 week
United States
$105
- +
100g
99%
1 week
United States
$212
- +
Product Description
Catalog Number:
AG003F41
Chemical Name:
1-Phenyl-2-(phenylsulfonyl)ethanone
CAS Number:
3406-03-9
Molecular Formula:
C14H12O3S
Molecular Weight:
260.3083
MDL Number:
MFCD00025043
IUPAC Name:
2-(benzenesulfonyl)-1-phenylethanone
InChI:
InChI=1S/C14H12O3S/c15-14(12-7-3-1-4-8-12)11-18(16,17)13-9-5-2-6-10-13/h1-10H,11H2
InChI Key:
DREVPGKOIZVPQV-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CS(=O)(=O)c1ccccc1
EC Number:
222-292-0
Properties
Complexity:
368  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.051g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.307g/mol
Monoisotopic Mass:
260.051g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Synthesis of Diarylpyrazoles Containing a Phenylsulphone or Carbonitrile Moiety and their Chalcones as Possible Anti-Inflammatory Agents. Scientia pharmaceutica 20110101
Diels-Alder/thiol-olefin co-oxygenation approach to antimalarials incorporating the 2,3-dioxabicyclo[3.3.1]nonane pharmacophore. Bioorganic & medicinal chemistry letters 20060601
X-ray investigations of sulfur-containing fungicides. III. Intramolecular forces governing the conformation of a novel orthorhombic polymorph of benzoylmethyl phenyl sulfone, benzoylmethyl 4-chlorophenyl sulfone and benzoylphenylmethyl phenyl sulfone. Acta crystallographica. Section B, Structural science 20011201
Properties