이름: dimethyl methylsuccinate
SMILES:
COC(=O)CC(C)C(=O)OCMolecular Processing
Molecular formula
C7H12O4
Molecular weight
160.17
Exact mass
160.0736
XLogP
0.36
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
37.81
Supplementary Information
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