SMILES:
O=C(OCc1ccccc1)c1cc(Br)c(OCc2ccccc2)cc1OCc1ccccc1Molecular Processing
Molecular formula
C28H23BrO4
Molecular weight
503.39
Exact mass
502.078
XLogP
6.96
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.107
Molar refractivity
131.25
Supplementary Information
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