CCOC(=O)CCC1(C)OOC(C)(C)CC(C)O1
الاسم: 3-(ethoxycarbonylethyl)-3,5,7,7-tetramethyl-1,2,4-trioxacycloheptane
SMILES: CCOC(=O)CCC1(C)OOC(C)(C)CC(C)O1

Molecular Processing

Molecular formula
C13H24O5
Molecular weight
260.33
Exact mass
260.1624
XLogP
2.58
TPSA
53.99
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
65.69

Supplementary Information

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