이름: [phenylmethyl]-1H-benzotriazole
SMILES:
c1ccc(Cn2nnc3ccccc32)cc1Molecular Processing
Molecular formula
C13H11N3
Molecular weight
209.25
Exact mass
209.0953
XLogP
2.48
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
63.07
Supplementary Information
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