SMILES:
CCC(OC(C)=O)OC(=O)Oc1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C12H13NO7
Molecular weight
283.24
Exact mass
283.0692
XLogP
2.41
TPSA
104.97
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
66.05
Supplementary Information
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