176673-72-6 Purity
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The molecular formula of 1-Bromo-2,3,6-trifluorobenzene is C6H2BrF3.
The molecular weight of 1-Bromo-2,3,6-trifluorobenzene is 210.98 g/mol.
The IUPAC name of 1-Bromo-2,3,6-trifluorobenzene is 2-bromo-1,3,4-trifluorobenzene.
The InChI of 1-Bromo-2,3,6-trifluorobenzene is InChI=1S/C6H2BrF3/c7-5-3(8)1-2-4(9)6(5)10/h1-2H.
The InChIKey of 1-Bromo-2,3,6-trifluorobenzene is CNAXDCSHYHIOGW-UHFFFAOYSA-N.
The canonical SMILES of 1-Bromo-2,3,6-trifluorobenzene is C1=CC(=C(C(=C1F)F)Br)F.
The CAS number of 1-Bromo-2,3,6-trifluorobenzene is 176793-04-7.
The XLogP3-AA value of 1-Bromo-2,3,6-trifluorobenzene is 2.9.
1-Bromo-2,3,6-trifluorobenzene has 0 hydrogen bond donor count.
1-Bromo-2,3,6-trifluorobenzene has 3 hydrogen bond acceptor counts.