SMILES:
COC(=O)CCc1cccc(I)c1Molecular Processing
Molecular formula
C10H11IO2
Molecular weight
290.1
Exact mass
289.9804
XLogP
2.4
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
59.5
Supplementary Information
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