SMILES:
CCCCCCCCC(CCC)C(=O)OMolecular Processing
Molecular formula
C13H26O2
Molecular weight
214.35
Exact mass
214.1933
XLogP
4.24
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
10
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
64.03
Supplementary Information
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