名称: 2-(6-carbethoxyhexyl)cyclopent-2-en-1-one
SMILES:
CCOC(=O)CCCCCCC1=CCCC1=OMolecular Processing
Molecular formula
C14H22O3
Molecular weight
238.33
Exact mass
238.1569
XLogP
3.18
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
66.66
Supplementary Information
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