Name: [2-fluoro-6-(4-fluorophenyl)sulfanylphenyl]methanol
SMILES:
C1=CC(=C(C(=C1)SC2=CC=C(C=C2)F)CO)FMolecular Processing
Molecular formula
C13H10F2OS
Molecular weight
252.28
Exact mass
252.042
XLogP
3.61
TPSA
20.23
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
62.85
Supplementary Information
InChIKey: ZIWFZYFEVAQUIK-UHFFFAOYSA-N
Synonyme
SCHEMBL9330192ZIWFZYFEVAQUIK-UHFFFAOYSA-N2-(4-fluorophenylthio)-6-fluorobenzyl alcohol
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