Chem 1 Hydroxy 2 Naphthoic Acid

Compound 33
  CheckMol                        TMF02:r0:m0
MF=C11H8O3 MW=188.18
 14 15  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0119   -1.4970   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3307   -2.2336   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2831   -2.2336   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5782   -1.4614   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2713   -3.7306   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5663    0.0594   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8732   -2.1980   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5663   -4.4672   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8613   -3.6950   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1682   -1.4257   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1563   -4.4316   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4632   -2.1623   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4513   -3.6593   -0.0000 C   0 00  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
  8 10 01  0  2  0  0
  8 11 02  0  1  0  0
 10 12 02  0  1  0  0
 11 13 01  0  1  0  0
 12 14 01  0  1  0  0
  9 10 01  0  1  0  0
 13 14 02  0  1  0  0
M  END

1-Hydroxy-2-Naphthoic Acid

₹ 0.00 0.00

Chemical Name - 1-Hydroxy-2-Naphthoic Acid
Mol Weight - 188.182
Smiles - OC(c(ccc1ccccc11)c1O)=O

Property Name	Property Value
Mol Name	1-Hydroxy-2-Naphthoic Acid
Molweight	188.182
Monoisotopic Mass	188.047345
Clogp	1.9934
Clogs	-2.939
H Acceptors	3
H Donors	2
Total Surface Area	138.31
Relative Psa	0.28371
Polar Surface Area	57.53
Druglikeness	-1.8442
Mutagenic	low
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Shape Index	0.57143
Molecular Flexibility	0.23557
Molecular Complexity	0.68153
Fragments	1
Non H Atoms	14
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	1
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3 Atoms	2
Acidic Oxygens	1
Smiles	OC(c(ccc1ccccc11)c1O)=O
InChIKey	InChI=1S/C11H8O3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H,(H,13,14)
InChI	SJJCQDRGABAVBB-UHFFFAOYSA-N

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1-Hydroxy-2-Naphthoic Acid