Name: methyl [o-(5-fluoro-2-nitrophenoxy)phenoxy]acetate
SMILES:
COC(=O)COc1ccccc1Oc1cc(F)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C15H12FNO6
Molecular weight
321.26
Exact mass
321.0649
XLogP
3.08
TPSA
87.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
77.08
Supplementary Information
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