CCOC(=O)C(F)(F)C(I)c1ccc(OC)cc1
SMILES: CCOC(=O)C(F)(F)C(I)c1ccc(OC)cc1

Molecular Processing

Molecular formula
C12H13F2IO3
Molecular weight
370.13
Exact mass
369.9877
XLogP
3.37
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
71.34

Supplementary Information

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