이름: 4-(5-fluoro-4-iodo-2-methylphenyl)-2-methylpyridine
SMILES:
Cc1cc(-c2cc(F)c(I)cc2C)ccn1Molecular Processing
Molecular formula
C13H11FIN
Molecular weight
327.14
Exact mass
326.992
XLogP
4.11
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
71.82
Supplementary Information
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