CAS
2378-86-1 Purity
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2378-86-1 Purity
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The molecular formula is C8H4BrF5.
The molecular weight is 275.01 g/mol.
The IUPAC name is 5-(bromomethyl)-1,2-difluoro-3-(trifluoromethyl)benzene.
The InChI is InChI=1S/C8H4BrF5/c9-3-4-1-5(8(12,13)14)7(11)6(10)2-4/h1-2H,3H2.
The InChIKey is ARGQEGUGAFKWBO-UHFFFAOYSA-N.
The Canonical SMILES is C1=C(C=C(C(=C1C(F)(F)F)F)F)CBr.
The CAS number is 239079-92-6.
The XLogP3-AA value is 3.6.
It has 0 hydrogen bond donor counts.
It has 5 hydrogen bond acceptor counts.