الاسم: 5-bromo-2-chloro-3-nitrobenzoic acid
SMILES:
O=C(O)c1cc(Br)cc([N+](=O)[O-])c1ClMolecular Processing
Molecular formula
C7H3BrClNO4
Molecular weight
280.46
Exact mass
278.8934
XLogP
2.71
TPSA
80.44
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
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
Molar refractivity
52.77
Supplementary Information
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