27246-81-7 Purity
98%
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The molecular formula of 3-Bromo thiophenol is C6H5BrS.
The molecular weight of 3-Bromo thiophenol is 189.07 g/mol.
The IUPAC Name of 3-Bromo thiophenol is 3-bromobenzenethiol.
The InChI of 3-Bromo thiophenol is InChI=1S/C6H5BrS/c7-5-2-1-3-6(8)4-5/h1-4,8H.
The InChIKey of 3-Bromo thiophenol is HNGQQUDFJDROPY-UHFFFAOYSA-N.
The canonical SMILES of 3-Bromo thiophenol is C1=CC(=CC(=C1)Br)S.
The CAS number of 3-Bromo thiophenol is 6320-01-0.
The EC number of 3-Bromo thiophenol is 228-664-9.
The DSSTox Substance ID of 3-Bromo thiophenol is DTXSID90212559.
Yes, 3-Bromo thiophenol is a canonicalized compound.