SMILES:
COC1(C)CCc2c(C)c(O)c(C)c(C)c2O1Molecular Processing
Molecular formula
C14H20O3
Molecular weight
236.31
Exact mass
236.1412
XLogP
3.01
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
66.68
Supplementary Information
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