Compound 38
  CheckMol                        TMF02:r0:m0
MF=C9H10O3 MW=166.18
 12 12  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3157   -0.7468   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6315    0.0237   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3276   -2.2403   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0356   -2.9871   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6433   -2.9752   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2565   -2.2284   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0474   -4.4806   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6552   -4.4687   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5485   -2.9633   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3631   -5.2155   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8405   -2.2047   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5 02  0  1  0  0
  4  6 01  0  1  0  0
  5  7  1  0  0  0  0
  5  8 01  0  1  0  0
  6  9 02  0  1  0  0
  7 10  1  0  0  0  0
  8 11 02  0  1  0  0
 10 12  1  0  0  0  0
  9 11 01  0  1  0  0
M  END

2D Structure

2-ETHOXY BENZOIC ACID

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Chemical Name - 2-ETHOXY BENZOIC ACID
Mol Weight - 166.175
Smiles - CCOc(cccc1)c1C(O)=O

Property Name	Property Value
Mol Name	2-ETHOXY BENZOIC ACID
Molweight	166.175
Monoisotopic Mass	166.062995
Clogp	1.481
Clogs	-1.947
H Acceptors	3
H Donors	1
Total Surface Area	133.38
Relative Psa	0.27096
Polar Surface Area	46.53
Druglikeness	-3.1527
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.58333
Molecular Flexibility	0.46186
Molecular Complexity	0.6553
Fragments	1
Non H Atoms	12
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	3
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	4
Acidic Oxygens	1
Smiles	CCOc(cccc1)c1C(O)=O
InChIKey

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