الاسم: 5-bromo-phenoxybenzonitrile
SMILES:
N#Cc1ccccc1Oc1cccc(Br)c1Molecular Processing
Molecular formula
C13H8BrNO
Molecular weight
274.12
Exact mass
272.9789
XLogP
4.11
TPSA
33.02
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
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
Molar refractivity
65.37
Supplementary Information
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