Name: (3-tert-Butoxy-5-fluoro-phenyl)-thiocarbamic acid O-isopropyl ester
SMILES:
CC(C)OC(=S)Nc1cc(F)cc(OC(C)(C)C)c1Molecular Processing
Molecular formula
C14H20FNO2S
Molecular weight
285.38
Exact mass
285.1199
XLogP
4.12
TPSA
30.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
79.22
Supplementary Information
Details werden geladen…
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