SMILES:
CC1(C)CCOc2c(I)cccc21Molecular Processing
Molecular formula
C11H13IO
Molecular weight
288.13
Exact mass
288.0011
XLogP
3.35
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
62.3
Supplementary Information
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