Название: (RS)-2-ethoxy-malonic acid monoethyl ester
SMILES:
CCOC(=O)C(OCC)C(=O)OMolecular Processing
Molecular formula
C7H12O5
Molecular weight
176.17
Exact mass
176.0685
XLogP
0.04
TPSA
72.83
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
39.68
Supplementary Information
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