Name: 2-amino-3-(5,6-dichloro-2H-benzotriazol-2-yl)-2-methylpropionitrile
SMILES:
CC(N)(C#N)Cn1nc2cc(Cl)c(Cl)cc2n1Molecular Processing
Molecular formula
C10H9Cl2N5
Molecular weight
270.12
Exact mass
269.0235
XLogP
1.98
TPSA
80.52
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
65.75
Supplementary Information
Details werden geladen…
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