Compound 82
  CheckMol                        TMF02:r0:m0
MF=C12H10O2S MW=218.27
 15 16  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7337    1.3136   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7574    1.3136   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2900   -0.7337   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3136   -0.7337   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2781   -2.2249   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5799    0.0237   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6273    0.0355   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3255   -2.2249   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5681   -2.9705   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8699   -0.7219   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9409   -0.6982   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6391   -2.9586   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8581   -2.2131   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9527   -2.1894   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6 02  0  1  0  0
  4  7 01  0  1  0  0
  5  8 02  0  1  0  0
  5  9 01  0  1  0  0
  6 10 01  0  1  0  0
  7 11 02  0  1  0  0
  8 12 01  0  1  0  0
  9 13 02  0  1  0  0
 10 14 02  0  1  0  0
 12 15 02  0  1  0  0
 11 14 01  0  1  0  0
 13 15 01  0  1  0  0
M  END

2D Structure

Diphenyl Sulfone

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Chemical Name - Diphenyl Sulfone
Mol Weight - 218.275
Smiles - O=S(c1ccccc1)(c1ccccc1)=O

Property Name	Property Value
Mol Name	Diphenyl Sulfone
Molweight	218.275
Monoisotopic Mass	218.04015
Clogp	2.3648
Clogs	-3.152
H Acceptors	2
Total Surface Area	161.6
Relative Psa	0.17686
Polar Surface Area	42.52
Druglikeness	-10.461
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.6
Molecular Flexibility	0.52525
Molecular Complexity	0.53051
Fragments	1
Non H Atoms	15
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	1
Symmetric Atoms	9
Smiles	O=S(c1ccccc1)(c1ccccc1)=O
InChIKey	InChI=1S/C12H10O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChI	KZTYYGOKRVBIMI-UHFFFAOYSA-N

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1 — Diphenyl Sulfone | 2 — Diphenyl Sulfone