SMILES:
N#Cc1ccccc1-c1ccc2cc(CBr)ccc2c1Molecular Processing
Molecular formula
C18H12BrN
Molecular weight
322.2
Exact mass
321.0153
XLogP
5.27
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.056
Molar refractivity
86.73
Supplementary Information
Details werden geladen…
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