Nombre: 1-(4-bromo-2-thienyl)-1-propanone
SMILES:
CCC(=O)c1cc(Br)cs1Molecular Processing
Molecular formula
C7H7BrOS
Molecular weight
219.1
Exact mass
217.9401
XLogP
3.1
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
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
0.286
Molar refractivity
46.64
Supplementary Information
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