이름: ethyl 2,4-dioxovalerate
SMILES:
CCOC(=O)C(=O)CC(C)=OMolecular Processing
Molecular formula
C7H10O4
Molecular weight
158.15
Exact mass
158.0579
XLogP
0.1
TPSA
60.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
11
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
0.571
Molar refractivity
36.94
Supplementary Information
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