الاسم: (8-bromo-quinolin-6-yl)-acetonitrile
SMILES:
N#CCc1cc(Br)c2ncccc2c1Molecular Processing
Molecular formula
C11H7BrN2
Molecular weight
247.09
Exact mass
245.9793
XLogP
3.06
TPSA
36.68
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
14
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
0.091
Molar refractivity
58.76
Supplementary Information
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