Name: Methyl acetoacetate sodium salt
SMILES:
COC(=O)CC(C)=O.[Na]Molecular Processing
Molecular formula
C5H8NaO3
Molecular weight
139.11
Exact mass
139.0371
XLogP
-0.24
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.6
Molar refractivity
33.07
Supplementary Information
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