Name: title compound
SMILES:
O=C(O)C1(CC2CC2)CCC1Molecular Processing
Molecular formula
C9H14O2
Molecular weight
154.21
Exact mass
154.0994
XLogP
2.04
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.889
Molar refractivity
41.26
Supplementary Information
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