Nom: Methyl 3-amino-5-bromo-4-fluoro-2-methoxybenzoate
SMILES:
COC(=O)c1cc(Br)c(F)c(N)c1OCMolecular Processing
Molecular formula
C9H9BrFNO3
Molecular weight
278.08
Exact mass
276.975
XLogP
1.97
TPSA
61.55
H-bond donors
1
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
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
56.4
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→