O=[N+]([O-])c1cc(CBr)n(CCBr)n1
SMILES: O=[N+]([O-])c1cc(CBr)n(CCBr)n1

Molecular Processing

Molecular formula
C6H7Br2N3O2
Molecular weight
312.95
Exact mass
310.8905
XLogP
2.08
TPSA
60.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
55.31

Supplementary Information

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