SMILES:
Fc1ccc(Oc2cccc(CBr)c2)cc1Molecular Processing
Molecular formula
C13H10BrFO
Molecular weight
281.12
Exact mass
279.9899
XLogP
4.51
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
65.55
Supplementary Information
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