SMILES:
Fc1ccc(Br)c(OC2CCNCC2)c1Molecular Processing
Molecular formula
C11H13BrFNO
Molecular weight
274.13
Exact mass
273.0165
XLogP
2.72
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
60.62
Supplementary Information
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