Name: ethyl 8-fluoro-1,2,3,4-tetrahydrodibenzo[b,d]thiophene-2-carboxylate
SMILES:
CCOC(=O)C1CCc2sc3ccc(F)cc3c2C1Molecular Processing
Molecular formula
C15H15FO2S
Molecular weight
278.35
Exact mass
278.0777
XLogP
3.71
TPSA
26.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
73.93
Supplementary Information
Details werden geladen…
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