Compound 91
  CheckMol                        TMF02:r0:m0
MF=C12H10 MW=154.21
 12 13  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3108   -0.7322   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2872   -0.7440   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5115   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6216    0.0354   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3226   -2.2201   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5743    0.0118   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2754    2.2673   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9324   -0.6967   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6334   -2.9522   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5625    1.5233   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9442   -2.1846   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3 02  0  1  0  0
  1  4 01  0  1  0  0
  2  5 02  0  1  0  0
  2  6 01  0  1  0  0
  3  7 01  0  1  0  0
  4  8 02  0  1  0  0
  5  9 01  0  1  0  0
  6 10 02  0  1  0  0
  7 11 02  0  1  0  0
  9 12 02  0  1  0  0
  8 11 01  0  1  0  0
 10 12 01  0  1  0  0
M  END

2D Structure

Biphenyl

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Chemical Name - Biphenyl
Mol Weight - 154.211
Smiles - c(cc1)ccc1-c1ccccc1

Property Name	Property Value
Mol Name	Biphenyl
Molweight	154.211
Monoisotopic Mass	154.07825
Clogp	3.3188
Clogs	-3.702
Total Surface Area	133.02
Druglikeness	-2.1841
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Shape Index	0.66667
Molecular Flexibility	0.37386
Molecular Complexity	0.41415
Fragments	1
Non H Atoms	12
Rotatable Bonds	1
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetric Atoms	8
Smiles	c(cc1)ccc1-c1ccccc1
InChIKey	InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H
InChI	ZUOUZKKEUPVFJK-UHFFFAOYSA-N

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1 — Biphenyl | 2 — Biphenyl