الاسم: 6-methyl-1,4-dioxaspiro[4.5]decane-6-propionic acid methyl ester
SMILES:
COC(=O)CCC1(C)CCCCC12OCCO2Molecular Processing
Molecular formula
C13H22O4
Molecular weight
242.31
Exact mass
242.1518
XLogP
2.26
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
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
0.923
Molar refractivity
62.46
Supplementary Information
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