SMILES:
COc1cc2[nH]c(C)c(I)c(=O)c2cc1ClMolecular Processing
Molecular formula
C11H9ClINO2
Molecular weight
349.56
Exact mass
348.9367
XLogP
3.1
TPSA
42.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
73.58
Supplementary Information
Details werden geladen…
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