SMILES:
CCCC(=O)OC1(C)CCCC(C)(C)C12CCC(C)O2Molecular Processing
Molecular formula
C17H30O3
Molecular weight
282.42
Exact mass
282.2195
XLogP
4.24
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.941
Molar refractivity
79.55
Supplementary Information
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