(5aR,10bS)-2-mesityl-9-nitro-5a,10b-dihydro-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazin-2-ium tetrafluoroborate, 98%

cas: 2128740-77-0 — see every product listed under this CAS number, including other names

(5aR,10bS)-2-mesityl-9-nitro-5a,10b-dihydro-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazin-2-ium tetrafluoroborate, 98% (CAS 2128740-77-0) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 250mg, 1g. Offered by: Fluorochem, Ambeed.

• 2D
• 3D

(1S,9R)-14-nitro-4-(2,4,6-trimethylphenyl)-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11(16),12,14-pentaene tetrafluoroborate (CAS 2128740-77-0) is a chemical compound with the molecular formula C21H21BF4N4O3 and a molecular weight of 464.2 g/mol. IUPAC name: (1S,9R)-14-nitro-4-(2,4,6-trimethylphenyl)-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11(16),12,14-pentaene tetrafluoroborate. InChIKey: FKSLCSHLKRJEDV-WKOQGQMTSA-N.

Identity

Molecular formula	C21H21BF4N4O3
Molecular weight	464.2 g/mol
IUPAC name	(1S,9R)-14-nitro-4-(2,4,6-trimethylphenyl)-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11(16),12,14-pentaene tetrafluoroborate
InChIKey	FKSLCSHLKRJEDV-WKOQGQMTSA-N
SMILES	[B-](F)(F)(F)F.CC1=CC(=C(C(=C1)C)N2C=[N+]3[C@@H]4[C@@H](CC5=C4C=C(C=C5)[N+](=O)[O-])OCC3=N2)C

Computed by PubChem (NCBI)

Related forms of this compound

(1R,9S)-14-nitro-4-(2,4,6-trimethylphenyl)-8-oxa-4,5-diaza-2-azoniatetracyclo[7.7.0.02,6.011,16]hexadeca-2,5,11(16),12,14-pentaene tetrafluoroborate C₂₁H₂₁BF₄N₄O₃