SMILES:
COc1cccc(O)c1C=OMolecular Processing
Molecular formula
C8H8O3
Molecular weight
152.15
Exact mass
152.0473
XLogP
1.21
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
40.05
Supplementary Information
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