Account 2-(Perfluorophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-2-ium tetrafluoroborate
- Catalog No. :
- ACTDYP158
- CAS No. :
- 1609525-91-8
- Molecular Formula :
- C13H11BF9N3
- Molecular Weight :
- 391.05
IUPAC Name:2-(perfluorophenyl)-2,5,6,7,8,9-hexahydro-[1,2,4]triazolo[4,3-a]azepin-4-ium tetrafluoroborate
![2-(Perfluorophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-2-ium tetrafluoroborate structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/26nd/1609525-91-8.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260731%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260731T075631Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%221609525-91-8.png%22&x-id=GetObject&X-Amz-Signature=3aadda1a7fb26a82183852a60c7a65a7477452f37f268246b8e1a4c69d9c0950)
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Product Information
| Product Name | 2-(Perfluorophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-2-ium tetrafluoroborate |
|---|---|
| IUPAC Name | 2-(perfluorophenyl)-2,5,6,7,8,9-hexahydro-[1,2,4]triazolo[4,3-a]azepin-4-ium tetrafluoroborate |
| Molecular Formula | C13H11BF9N3 |
| Molecular Weight | 391.05 |
| SMILES | FC1=C(F)C(F)=C(N2C=[N+]3CCCCCC3=N2)C(F)=C1F.F[B-](F)(F)F |
| InChI Key | QAIJLEWIDPPHBD-UHFFFAOYSA-N |
| Synonym | 2-(Perfluorophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-2-ium tetrafluoroborate;2-(Pentafluorophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-2-ium tetrafluoroborate |
| CAS No. | 1609525-91-8 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H314
- Precautionary Statement(s)
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340+P310-P305+P351+P338+P310-P363-P405-P501
Synthetic Route by SureRoute
2. ACTDYP158 Molecular Building Block Synthetic Route
![6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate structure diagram](/images/productimg/no-pic.svg)
6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate
![(R)-5-isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/1don/1175052-07-9.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260731%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260731T072502Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%221175052-07-9.png%22&x-id=GetObject&X-Amz-Signature=d2f7d12b6d7c4f99680771bf3a24a871d5d8133a715ea0fbe9d14e6be013086f)
(R)-5-isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
(5R,7R)-5-(tert-Butyl)-7-fluoro-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate