Name: 1-hydroxybenzotriazine hydrate
SMILES:
O.ON1NN=Cc2ccccc21Molecular Processing
Molecular formula
C7H9N3O2
Molecular weight
167.17
Exact mass
167.0695
XLogP
-0.09
TPSA
79.36
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0
Molar refractivity
45.05
Supplementary Information
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