Название: 2-(3-fluoro-4-methoxy-phenyl)-cyclopropanecarboxylic acid ethyl ester
SMILES:
CCOC(=O)C1CC1c1ccc(OC)c(F)c1Molecular Processing
Molecular formula
C13H15FO3
Molecular weight
238.26
Exact mass
238.1005
XLogP
2.5
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
60.43
Supplementary Information
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