SMILES:
O=C(CN1CCOCC1)Nc1ccc([N+](=O)[O-])cc1Molecular Processing
Molecular formula
C12H15N3O4
Molecular weight
265.27
Exact mass
265.1063
XLogP
0.87
TPSA
84.71
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
68.99
Supplementary Information
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