الاسم: iso-butyl 2-oxobutanoate
SMILES:
CCC(=O)C(=O)OCC(C)CMolecular Processing
Molecular formula
C8H14O3
Molecular weight
158.2
Exact mass
158.0943
XLogP
1.16
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
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
3
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
41.1
Supplementary Information
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