SMILES:
OCCOC1(c2cccc(O)c2)OOC12C1CC3CC(C1)CC2C3Molecular Processing
Molecular formula
C19H24O5
Molecular weight
332.4
Exact mass
332.1624
XLogP
2.71
TPSA
68.15
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24
Rings
6
Aromatic rings
1
Saturated rings
5
Aliphatic rings
5
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.684
Molar refractivity
84.77
Supplementary Information
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