Name: ethyl 3-oxo-4-(3-pyridyloxy)butanoate
SMILES:
CCOC(=O)CC(=O)COc1cccnc1Molecular Processing
Molecular formula
C11H13NO4
Molecular weight
223.23
Exact mass
223.0845
XLogP
0.98
TPSA
65.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
55.99
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→