SMILES:
O=C(O)C1CCc2cc(OCc3ccccc3)ccc2C1OMolecular Processing
Molecular formula
C18H18O4
Molecular weight
298.34
Exact mass
298.1205
XLogP
2.95
TPSA
66.76
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
81.62
Supplementary Information
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