SMILES:
CC(=O)OC(=O)c1ccccc1OMolecular Processing
Molecular formula
C9H8O4
Molecular weight
180.16
Exact mass
180.0423
XLogP
1.1
TPSA
63.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
44.2
Supplementary Information
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