Name: 3-iodo-1-methyl-6-(trifluoromethyl)-1H-indazole
SMILES:
Cn1nc(I)c2ccc(C(F)(F)F)cc21Molecular Processing
Molecular formula
C9H6F3IN2
Molecular weight
326.06
Exact mass
325.9528
XLogP
3.2
TPSA
17.82
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
15
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
0.222
Molar refractivity
58.43
Supplementary Information
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