SMILES:
O=C(O)c1ccc2c(c1)C(=O)C(Br)CC2Molecular Processing
Molecular formula
C11H9BrO3
Molecular weight
269.09
Exact mass
267.9735
XLogP
2.28
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
58.77
Supplementary Information
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