Nombre: 13
SMILES:
COc1ccc2c(=O)c(Br)coc2c1Molecular Processing
Molecular formula
C10H7BrO3
Molecular weight
255.07
Exact mass
253.9579
XLogP
2.56
TPSA
39.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
56.74
Supplementary Information
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