Name: 3-ethoxythiocarbonylthio-4-fluorobenzotrifluoride
SMILES:
CCOC(=S)Sc1cc(C(F)(F)F)ccc1FMolecular Processing
Molecular formula
C10H8F4OS2
Molecular weight
284.3
Exact mass
283.9953
XLogP
4.26
TPSA
9.23
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
61.48
Supplementary Information
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