SMILES:
CCOC(=O)C1=C(c2ccccc2)c2ccc(OC)cc2C1OCCMolecular Processing
Molecular formula
C21H22O4
Molecular weight
338.4
Exact mass
338.1518
XLogP
4.15
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
96.46
Supplementary Information
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