SMILES:
O=C1OC2CC1CCC2IMolecular Processing
Molecular formula
C7H9IO2
Molecular weight
252.05
Exact mass
251.9647
XLogP
1.52
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
45.03
Supplementary Information
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