الاسم: Ketone
SMILES:
COC(=O)C1CC(=O)CN1C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C14H15NO5
Molecular weight
277.28
Exact mass
277.095
XLogP
1.14
TPSA
72.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
68.76
Supplementary Information
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