COC(=O)C1(c2ccc(O)c([N+](=O)[O-])c2)CC1
SMILES: COC(=O)C1(c2ccc(O)c([N+](=O)[O-])c2)CC1

Molecular Processing

Molecular formula
C11H11NO5
Molecular weight
237.21
Exact mass
237.0637
XLogP
1.5
TPSA
89.67
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
57.69

Supplementary Information

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