이름: acetol
SMILES:
CC(=O)COMolecular Processing
Molecular formula
C3H6O2
Molecular weight
74.08
Exact mass
74.0368
XLogP
-0.43
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
5
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
17.77
Supplementary Information
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