CAS
111-85-3 Purity
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111-85-3 Purity
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Specification
The molecular formula is C3H4BrF3O.
The molecular weight is 192.96 g/mol.
The IUPAC name is 1-bromo-2-(trifluoromethoxy)ethane.
The InChI is InChI=1S/C3H4BrF3O/c4-1-2-8-3(5,6)7/h1-2H2.
The InChIKey is YLLDCQMJIXHFQZ-UHFFFAOYSA-N.
The canonical SMILES is C(CBr)OC(F)(F)F.
The CAS number is 1645-93-8.
The European Community (EC) number is 803-235-4.
The DSSTox Substance ID is DTXSID80511341.
Yes, 1-Bromo-2-(trifluoromethoxy)ethane is canonicalized according to PubChem.