SMILES:
CCOC(C#CCOC1CCCCO1)OCCMolecular Processing
Molecular formula
C13H22O4
Molecular weight
242.31
Exact mass
242.1518
XLogP
1.93
TPSA
36.92
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.846
Molar refractivity
64.36
Supplementary Information
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