Nombre: (3-oxo-4-propyl-cyclohexyl)-acetic acid
SMILES:
CCCC1CCC(CC(=O)O)CC1=OMolecular Processing
Molecular formula
C11H18O3
Molecular weight
198.26
Exact mass
198.1256
XLogP
2.25
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
53
Supplementary Information
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