이름: 4-Bromo-3-chloro-1,2-benzenediamine
SMILES:
Nc1ccc(Br)c(Cl)c1NMolecular Processing
Molecular formula
C6H6BrClN2
Molecular weight
221.49
Exact mass
219.9403
XLogP
2.27
TPSA
52.04
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
47.98
Supplementary Information
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