Название: Methyl 2-chloro-3-{4-[2-(4-hydroxyphenoxy)ethyl]phenyl}propanoate
SMILES:
COC(=O)C(Cl)Cc1ccc(CCOc2ccc(O)cc2)cc1Molecular Processing
Molecular formula
C18H19ClO4
Molecular weight
334.8
Exact mass
334.0972
XLogP
3.34
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
89.11
Supplementary Information
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