名称: ethyl 2-(3,5-difluoro-4-hydroxyphenyl)cyclopropane-1-carboxylate
SMILES:
CCOC(=O)C1CC1c1cc(F)c(O)c(F)c1Molecular Processing
Molecular formula
C12H12F2O3
Molecular weight
242.22
Exact mass
242.0755
XLogP
2.34
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
55.5
Supplementary Information
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