이름: 6-(4-Fluoro-phenyl)-2-methyl-nicotinic acid ethyl ester
SMILES:
CCOC(=O)c1ccc(-c2ccc(F)cc2)nc1CMolecular Processing
Molecular formula
C15H14FNO2
Molecular weight
259.28
Exact mass
259.1009
XLogP
3.37
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
70.32
Supplementary Information
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