SMILES:
Oc1cc(O)c(-c2c(O)cc(O)cc2CBr)c(CBr)c1Molecular Processing
Molecular formula
C14H12Br2O4
Molecular weight
404.05
Exact mass
401.9102
XLogP
3.97
TPSA
80.92
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
83.8
Supplementary Information
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