SMILES:
COc1ccc2c(C(=O)O)ccc(OC)c2c1Molecular Processing
Molecular formula
C13H12O4
Molecular weight
232.23
Exact mass
232.0736
XLogP
2.56
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
64.01
Supplementary Information
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