CCOC(=O)C1(CCCCC(=O)CCCCC2(C(=O)OCC)CCC2)CCC1
Name: ethyl 1-9-[1-(ethoxycarbonyl)cyclobutyl]-5-oxononyl-1-cyclobutanecarboxylate
SMILES: CCOC(=O)C1(CCCCC(=O)CCCCC2(C(=O)OCC)CCC2)CCC1

Molecular Processing

Molecular formula
C23H38O5
Molecular weight
394.55
Exact mass
394.2719
XLogP
5.14
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
14
Heavy atoms
28
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.87
Molar refractivity
107.78

Supplementary Information

Details werden geladen…

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