Name: 2-[2-methoxy-3-(2-chlorophenoxy)phenyl]butyric acid
SMILES:
CCC(C(=O)O)c1cccc(Oc2ccccc2Cl)c1OCMolecular Processing
Molecular formula
C17H17ClO4
Molecular weight
320.77
Exact mass
320.0815
XLogP
4.72
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
22
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
0.235
Molar refractivity
85.19
Supplementary Information
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