Name: ethyl (2Z)-4,4,4-trifluoro-3-iodobut-2-enoate
SMILES:
CCOC(=O)/C=C(\I)C(F)(F)FMolecular Processing
Molecular formula
C6H6F3IO2
Molecular weight
294.01
Exact mass
293.9365
XLogP
2.43
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
44.79
Supplementary Information
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