Название: 4-(6-phenyl-1,4-dioxaspiro[4.5]decan-6-yl)butanoic acid
SMILES:
O=C(O)CCCC1(c2ccccc2)CCCCC12OCCO2Molecular Processing
Molecular formula
C18H24O4
Molecular weight
304.39
Exact mass
304.1675
XLogP
3.5
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
82.71
Supplementary Information
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