SMILES:
O=[N+]([O-])c1c(CBr)cc(CBr)cc1CBrMolecular Processing
Molecular formula
C9H8Br3NO2
Molecular weight
401.88
Exact mass
398.8105
XLogP
4.28
TPSA
43.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
70.99
Supplementary Information
Récupération des détails…
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