Nombre: product
SMILES:
COC(=O)C(Oc1ccc(C)cc1Cl)c1ccccc1Molecular Processing
Molecular formula
C16H15ClO3
Molecular weight
290.75
Exact mass
290.071
XLogP
3.94
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
78.02
Supplementary Information
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