Nombre: Compound 1d
SMILES:
O=C(O)c1c(Cl)c(F)c(=O)n2c1CCC2Molecular Processing
Molecular formula
C9H7ClFNO3
Molecular weight
231.61
Exact mass
231.0098
XLogP
1.29
TPSA
59.3
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
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.95
Supplementary Information
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