SMILES:
CC12CCC(C(=O)CC1=O)C2(C)CMolecular Processing
Molecular formula
C11H16O2
Molecular weight
180.25
Exact mass
180.115
XLogP
1.97
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
49.24
Supplementary Information
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