COC(=O)Oc1cc([N+](=O)[O-])c(F)cc1Cl
SMILES: COC(=O)Oc1cc([N+](=O)[O-])c(F)cc1Cl

Molecular Processing

Molecular formula
C8H5ClFNO5
Molecular weight
249.58
Exact mass
248.984
XLogP
2.53
TPSA
78.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
51.1

Supplementary Information

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