Nombre: hexane ethyl acetate methanol acetic acid
SMILES:
CC(=O)O.CCCCCC.CCOC(C)=O.COMolecular Processing
Molecular formula
C13H30O5
Molecular weight
266.38
Exact mass
266.2093
XLogP
2.86
TPSA
83.83
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
4
Fraction Csp3
0.846
Molar refractivity
73.58
Supplementary Information
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