Nom: methyl 3-amino-5-bromothiophene-2-carboxylate
SMILES:
COC(=O)c1sc(Br)cc1NMolecular Processing
Molecular formula
C6H6BrNO2S
Molecular weight
236.09
Exact mass
234.9303
XLogP
1.88
TPSA
52.32
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
47.77
Supplementary Information
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