이름: ethyl 4-ethoxy-2-oxopent-3-enoate
SMILES:
CCOC(=O)C(=O)C=C(C)OCCMolecular Processing
Molecular formula
C9H14O4
Molecular weight
186.21
Exact mass
186.0892
XLogP
1.06
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
13
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
0.556
Molar refractivity
47.02
Supplementary Information
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