SMILES:
O=C(CO)CCCCCCC1=CCCC12OCCO2Molecular Processing
Molecular formula
C15H24O4
Molecular weight
268.35
Exact mass
268.1675
XLogP
2.35
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
19
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
71.75
Supplementary Information
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