SMILES:
CC(=O)Oc1cc(C(=O)N=C=O)cc(OC(C)=O)c1OC(C)=OMolecular Processing
Molecular formula
C14H11NO8
Molecular weight
321.24
Exact mass
321.0485
XLogP
0.94
TPSA
125.4
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
72.82
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→