COc1cc(F)ccc1C(=O)O
Name: 4-fluoro-2-methoxybenzoic acid
SMILES: COc1cc(F)ccc1C(=O)O

Molecular Processing

Molecular formula
C8H7FO3
Molecular weight
170.14
Exact mass
170.0379
XLogP
1.53
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
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
39.91

Supplementary Information

Details werden geladen…

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