SMILES:
COc1ccc(C2CO2)cc1FMolecular Processing
Molecular formula
C9H9FO2
Molecular weight
168.17
Exact mass
168.0587
XLogP
1.91
TPSA
21.76
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
41.65
Supplementary Information
Details werden geladen…
An 6 Reaktionen beteiligt→