Nombre: 4-(methoxycarbonylmethoxy)-3-nitrophenol
SMILES:
COC(=O)COc1ccc(O)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C9H9NO6
Molecular weight
227.17
Exact mass
227.043
XLogP
0.85
TPSA
98.9
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
52.27
Supplementary Information
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