Name: 6-Bromo-1-methyl-1H-indazole-4-carbonitrile
SMILES:
Cn1ncc2c(C#N)cc(Br)cc21Molecular Processing
Molecular formula
C9H6BrN3
Molecular weight
236.07
Exact mass
234.9745
XLogP
2.21
TPSA
41.61
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
53.13
Supplementary Information
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