名称: 1-(2,2-Dimethylpropyl)-5-nitro-1H-1,2,3-benzotriazole
SMILES:
CC(C)(C)Cn1nnc2cc([N+](=O)[O-])ccc21Molecular Processing
Molecular formula
C11H14N4O2
Molecular weight
234.26
Exact mass
234.1117
XLogP
2.39
TPSA
73.85
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
63.64
Supplementary Information
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