Name: 5-(bromomethyl)-1,3-difluoro-2-(methylthio)benzene
SMILES:
CSc1c(F)cc(CBr)cc1FMolecular Processing
Molecular formula
C8H7BrF2S
Molecular weight
253.11
Exact mass
251.942
XLogP
3.58
TPSA
0
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
50.77
Supplementary Information
Details werden geladen…
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