Name: ethyl 1-(4-fluorophenyl)-1H-imidazole-5-carboxylate
SMILES:
CCOC(=O)c1cncn1-c1ccc(F)cc1Molecular Processing
Molecular formula
C12H11FN2O2
Molecular weight
234.23
Exact mass
234.0805
XLogP
2.19
TPSA
44.12
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
59.48
Supplementary Information
Details werden geladen…
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