Compound 249
  CheckMol                        TMF02:r0:m0
MF=C6H5N3O MW=135.13
 10 11  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3176   -0.7411   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -2.7057   -0.1176   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -1.4823   -2.2234   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.7174   -1.2235   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -2.9645   -2.5293   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.4941   -3.3292   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.4351   -3.9409   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.9646   -4.7409   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.4469   -5.0467   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 01  0  1  0  0
  2  4 01  0  1  0  0
  3  5 02  0  1  0  0
  4  6 02  0  2  0  0
  4  7 01  0  1  0  0
  6  8 01  0  1  0  0
  7  9 02  0  1  0  0
  8 10 02  0  1  0  0
  5  6 01  0  1  0  0
  9 10 01  0  1  0  0
M  END

2D Structure

1-Hydroxybenzotriazole

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Chemical Name - 1-Hydroxybenzotriazole
Mol Weight - 135.126
Smiles - On1nnc2c1cccc2

Property Name	Property Value
Mol Name	1-Hydroxybenzotriazole
Molweight	135.126
Monoisotopic Mass	135.043262
Clogp	0.6152
Clogs	-2.901
H Acceptors	4
H Donors	1
Total Surface Area	100.93
Relative Psa	0.41524
Polar Surface Area	50.94
Druglikeness	-4.8353
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Shape Index	0.6
Molecular Complexity	0.75224
Fragments	1
Non H Atoms	10
Non Ch Atoms	4
Electronegative Atoms	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	9
Sp3 Atoms	1
Aromatic Nitrogens	3
Basic Nitrogens	1
Smiles	On1nnc2c1cccc2
InChIKey	InChI=1S/C6H5N3O/c10-9-6-4-2-1-3-5(6)7-8-9/h1-4,10H
InChI	ASOKPJOREAFHNY-UHFFFAOYSA-N

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1 — 1-Hydroxybenzotriazole | 2 — 1-Hydroxybenzotriazole