SMILES:
CCCCCCOc1ccc(Br)cc1FMolecular Processing
Molecular formula
C12H16BrFO
Molecular weight
275.16
Exact mass
274.0369
XLogP
4.55
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
63.74
Supplementary Information
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