SMILES:
CC1(C[C@H]2[C@@H](C(=O)O)C2(C)C)OCCO1Molecular Processing
Molecular formula
C11H18O4
Molecular weight
214.26
Exact mass
214.1205
XLogP
1.5
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
53.32
Supplementary Information
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