SMILES:
CC(C)=CCCC(C)CCOC(=O)c1ccccc1C=OMolecular Processing
Molecular formula
C18H24O3
Molecular weight
288.39
Exact mass
288.1725
XLogP
4.43
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
84.56
Supplementary Information
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