SMILES:
CN(C)C(=S)Oc1ccc(Br)cc1C=OMolecular Processing
Molecular formula
C10H10BrNO2S
Molecular weight
288.17
Exact mass
286.9616
XLogP
2.49
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
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
0.2
Molar refractivity
66.44
Supplementary Information
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