Name: methyl 2-fluoro-5-nitrobenzoate
SMILES:
COC(=O)c1cc([N+](=O)[O-])ccc1FMolecular Processing
Molecular formula
C8H6FNO4
Molecular weight
199.14
Exact mass
199.0281
XLogP
1.52
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
44.39
Supplementary Information
Details werden geladen…
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