Name: 1-(4-fluoro phenyl)cyclohexanecarboxylic acid
SMILES:
O=C(O)C1(c2ccc(F)cc2)CCCCC1Molecular Processing
Molecular formula
C13H15FO2
Molecular weight
222.26
Exact mass
222.1056
XLogP
3.11
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
58.8
Supplementary Information
Details werden geladen…
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