Nom: compound
SMILES:
Cc1ccc(C(C(=O)OC(C)(C)C)C2CCCC2)cc1Molecular Processing
Molecular formula
C18H26O2
Molecular weight
274.4
Exact mass
274.1933
XLogP
4.61
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
81.72
Supplementary Information
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