SMILES:
CC(C)(O)CCCOMolecular Processing
Molecular formula
C6H14O2
Molecular weight
118.18
Exact mass
118.0994
XLogP
0.53
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
32.62
Supplementary Information
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