SMILES:
CC(C)(CCCC#CCOC1CCCCO1)C(=O)OMolecular Processing
Molecular formula
C15H24O4
Molecular weight
268.35
Exact mass
268.1675
XLogP
2.81
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
72.59
Supplementary Information
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