Название: methyl 2,4-difluoro-5-nitrobenzoate
SMILES:
COC(=O)c1cc([N+](=O)[O-])c(F)cc1FMolecular Processing
Molecular formula
C8H5F2NO4
Molecular weight
217.13
Exact mass
217.0187
XLogP
1.66
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
44.35
Supplementary Information
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