Name: 2-ethoxy-4-fluoro-benzoic acid ethyl ester
SMILES:
CCOC(=O)c1ccc(F)cc1OCCMolecular Processing
Molecular formula
C11H13FO3
Molecular weight
212.22
Exact mass
212.0849
XLogP
2.4
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
53.53
Supplementary Information
Details werden geladen…
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