Name: 5-fluoro-3-isobutyl-benzo[b]thiophene-2-sulfonyl chloride
SMILES:
CC(C)Cc1c(S(=O)(=O)Cl)sc2ccc(F)cc12Molecular Processing
Molecular formula
C12H12ClFO2S2
Molecular weight
306.81
Exact mass
305.9951
XLogP
4.17
TPSA
34.14
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
73.36
Supplementary Information
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