SMILES:
CC(O)C1CCCCC1Molecular Processing
Molecular formula
C8H16O
Molecular weight
128.22
Exact mass
128.1201
XLogP
1.95
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
38.26
Supplementary Information
Récupération des détails…
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