SMILES:
CCCCCC=O.OCC(O)COMolecular Processing
Molecular formula
C9H20O4
Molecular weight
192.25
Exact mass
192.1362
XLogP
0.1
TPSA
77.76
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.889
Molar refractivity
50.38
Supplementary Information
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