O=C(O)CCCC=CC1C2CCC(C2)C1CO
SMILES: O=C(O)CCCC=CC1C2CCC(C2)C1CO

Molecular Processing

Molecular formula
C14H22O3
Molecular weight
238.33
Exact mass
238.1569
XLogP
2.45
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
17
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.786
Molar refractivity
65.52

Supplementary Information

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