CAS
914225-12-0 Purity
---
914225-12-0 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
PubChem CID 45358382.
The molecular formula is C7H2BrClF4.
The molecular weight is 277.44 g/mol.
The IUPAC name is 5-bromo-1-chloro-2-fluoro-3-(trifluoromethyl)benzene.
The InChI is InChI=1S/C7H2BrClF4/c8-3-1-4(7(11,12)13)6(10)5(9)2-3/h1-2H.
The InChIKey is BBEDFMIZRIVTRI-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C=C(C(=C1C(F)(F)F)F)Cl)Br.
The CAS number is 914225-67-5.
The XLogP3-AA value is 4.2.
Yes, it is a canonicalized compound according to PubChem.