Compound 61
  CheckMol                        TMF02:r0:m0
MF=C7H6ClNO3 MW=187.58
 12 12  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0119   -1.4933   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3274   -2.2400   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2800   -2.2281   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6430   -1.4815   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3393   -3.7333   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2681   -3.7215   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6548    0.0356   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9585   -2.2163   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0474   -4.4681   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0593   -5.9615   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2326   -6.6963   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5  1  0  0  0  0
  3  6 01  0  1  0  0
  4  7 02  0  1  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10 02  0  1  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  7 10 01  0  1  0  0
M  CHG  1   5   1
M  CHG  1   9  -1
M  END

2D Structure

4 Chloro 3 Nitroanisole

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Chemical Name - 4 Chloro 3 Nitroanisole
Mol Weight - 187.582
Smiles -

Property Name	Property Value
Mol Name	4 Chloro 3 Nitroanisole
Molweight	187.582
Monoisotopic Mass	187.003621
Clogp	1.274
Clogs	-2.83
H Acceptors	4
Total Surface Area	134.61
Relative Psa	0.30027
Polar Surface Area	55.05
Druglikeness	-7.0887
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.58333
Molecular Flexibility	0.45794
Molecular Complexity	0.68515
Non H Atoms	12
Non Ch Atoms	5
Electronegative Atoms	5
Rotatable Bonds	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	3
Acidic Oxygens	1
Smiles

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