이름: ethyl 6-(N,N-diethylamino)-3-oxohexanoate
SMILES:
CCOC(=O)CC(=O)CCCN(CC)CCMolecular Processing
Molecular formula
C12H23NO3
Molecular weight
229.32
Exact mass
229.1678
XLogP
1.63
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
63.28
Supplementary Information
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