Cn1cc(Br)cn1
SMILES: Cn1cc(Br)cn1

Molecular Processing

Molecular formula
C4H5BrN2
Molecular weight
161
Exact mass
159.9636
XLogP
1.18
TPSA
17.82
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
30.91

Supplementary Information

Details werden geladen…

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