이름: 3′-amino-6,2′,6′-trifluorobiphenyl-2-carbonitrile
SMILES:
N#Cc1cccc(F)c1-c1c(F)ccc(N)c1FMolecular Processing
Molecular formula
C13H7F3N2
Molecular weight
248.21
Exact mass
248.0561
XLogP
3.22
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
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
Molar refractivity
60.88
Supplementary Information
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