Nombre: ethyl 2-{2-chloro-6-[(2,2,2-trifluoro-ethoxy)methyl]pyrimidin-4-yl}acetate
SMILES:
CCOC(=O)Cc1cc(COCC(F)(F)F)nc(Cl)n1Molecular Processing
Molecular formula
C11H12ClF3N2O3
Molecular weight
312.67
Exact mass
312.0489
XLogP
2.31
TPSA
61.31
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
63.09
Supplementary Information
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