Name: 3,4-dibromo-2,2-diphenylbutanenitrile
SMILES:
N#CC(c1ccccc1)(c1ccccc1)C(Br)CBrMolecular Processing
Molecular formula
C16H13Br2N
Molecular weight
379.1
Exact mass
376.9415
XLogP
4.65
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
85.79
Supplementary Information
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