名称: ethyl (3-chloro-2,4-difluoro-benzoyl)-acetate
SMILES:
CCOC(=O)CC(=O)c1ccc(F)c(Cl)c1FMolecular Processing
Molecular formula
C11H9ClF2O3
Molecular weight
262.64
Exact mass
262.0208
XLogP
2.75
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
56.95
Supplementary Information
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