SMILES:
CCOC(=O)C(C#N)CCCc1ccc(C(=O)OC)cc1Molecular Processing
Molecular formula
C16H19NO4
Molecular weight
289.33
Exact mass
289.1314
XLogP
2.5
TPSA
76.39
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
76.46
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→