SMILES:
COC(=O)c1cc(Br)c(OC)c(Br)c1Molecular Processing
Molecular formula
C9H8Br2O3
Molecular weight
323.97
Exact mass
321.884
XLogP
3.01
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
59.73
Supplementary Information
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