COC(=O)c1ccc(F)cc1N
Name: Methyl 2-amino-4-fluorobenzoate
SMILES: COC(=O)c1ccc(F)cc1N

Molecular Processing

Molecular formula
C8H8FNO2
Molecular weight
169.15
Exact mass
169.0539
XLogP
1.19
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
42.15

Supplementary Information

Details werden geladen…

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