SMILES:
C1CCCC2OC2CC1Molecular Processing
Molecular formula
C8H14O
Molecular weight
126.2
Exact mass
126.1045
XLogP
2.11
TPSA
12.53
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
36.36
Supplementary Information
Récupération des détails…
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