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Home Sulfos Benzyl phenyl sulfone

Benzyl phenyl sulfone

CAS No.:
3112-88-7
Catalog Number:
AG003260
Molecular Formula:
C13H12O2S
Molecular Weight:
232.2982
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98+%
1 week
United States
$52
- +
5g
98+%
1 week
United States
$69
- +
25g
98+%
1 week
United States
$131
- +
100g
98+%
1 week
United States
$321
- +
Product Description
Catalog Number:
AG003260
Chemical Name:
Benzyl phenyl sulfone
CAS Number:
3112-88-7
Molecular Formula:
C13H12O2S
Molecular Weight:
232.2982
MDL Number:
MFCD00025040
IUPAC Name:
benzenesulfonylmethylbenzene
InChI:
InChI=1S/C13H12O2S/c14-16(15,13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2
InChI Key:
FABCMLOTUSCWOR-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)Cc1ccccc1
EC Number:
221-477-3
NSC Number:
15407
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.056g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.297g/mol
Monoisotopic Mass:
232.056g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Studies of the condensation of sulfones with ketones and aldehydes. The Journal of organic chemistry 20060120
Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases. Journal of medicinal chemistry 20050421
Stereoselective conjugate addition of benzyl phenylsulfonyl carbanions to enoates derived from d-mannitol. The Journal of organic chemistry 20040611
Unexpected differences in the alpha-halogenation and related reactivity of sulfones with perhaloalkanes in KOH-t-BuOH. The Journal of organic chemistry 20030124
Properties