2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one
CAS Registry Number®
100563-50-6
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CAS Name
2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-oneMolecular Formula
C9H6BrFN4O3Molecular Mass
317.07Cite this Page
2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=100563-50-6 (retrieved ) (CAS RN: 100563-50-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C9H6BrFN4O3/c1-4-12-9(16)14(13-4)8-3-7(15(17)18)5(10)2-6(8)11/h2-3H,1H3,(H,12,13,16)
InChIKey
InChIKey=WXMYAHCQEDYPBH-UHFFFAOYSA-N
SMILES
FC=1C(=CC(N(=O)=O)=C(Br)C1)N2C(=O)NC(C)=N2
Canonical SMILES
O=C1NC(=NN1C=2C=C(C(Br)=CC2F)N(=O)=O)C
Other Names for this Substance
- 3H-1,2,4-Triazol-3-one, 2-(4-bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-
- 2-(4-Bromo-2-fluoro-5-nitrophenyl)-1,2-dihydro-5-methyl-3H-1,2,4-triazol-3-one
