Name: 6-propyl-1,4-dioxaspiro[4.5]decane6-propionic acid methyl ester
SMILES:
CCCC1(CCC(=O)OC)CCCCC12OCCO2Molecular Processing
Molecular formula
C15H26O4
Molecular weight
270.37
Exact mass
270.1831
XLogP
3.04
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.933
Molar refractivity
71.69
Supplementary Information
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