Account [(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP]-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1)
- Catalog No. :
- ACUKBA478
- CAS No. :
- 1798782-11-2
- Molecular Formula :
- C40H60F3O5PPdS
- Molecular Weight :
- 847.36
IUPAC Name:[(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP]-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1)
![[(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP]-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1) structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/f2ho/1798782-11-2.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260801%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260801T132652Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%221798782-11-2.png%22&x-id=GetObject&X-Amz-Signature=f473b7d2c4cafce655da5172759ab6800eb4e4010b1a5d96e66713d85949f149)
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Product Information
| Product Name | [(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP]-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1) |
|---|---|
| IUPAC Name | [(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP]-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1) |
| MDL No. | MFCD34790816 |
| Molecular Formula | C40H60F3O5PPdS |
| Molecular Weight | 847.36 |
| SMILES | O=S(=O)([O-])C(F)(F)F.O(C=1C=CC(OC)=C2C1C3(=C(C=C(C=C3C(C)C)C(C)C)C(C)C)[Pd+2]45([CH2-][CH]5=[CH]4C)[P]2(C6CCCCC6)C7CCCCC7)C |
| InChI Key | VYVPVDCHHXLSLC-UHFFFAOYSA-M |
| Synonym | BrettPhos Pd(crotyl)OTf;PD-173;(1,2,3-η)-2-Buten-1-yl][dicyclohexyl[3,6-dimethoxy-2′,4′,6′-tris(1-methylethyl)[1,1′-biphenyl]-2-yl-κC1′]phosphine-κP]palladium(1+) 1,1,1-trifluoromethanesulfonate;(1,2,3-η)-2-buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κc1']phosphine-κp]-palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1);Pd(crotyl)(BrettPhos)OTf;(1,2,3-η)-2-buten-1-yl][dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κc1']phosphine-κp]-palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1);Palladium(1+), [(1,2,3-η)-2-buten-1-yl][dicyclohexyl[3,6-dimethoxy-2′,4′,6′-tris… |
| CAS No. | 1798782-11-2 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H315-H319
- Precautionary Statement(s)
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364
Synthetic Route by SureRoute
2. ACUKBA478 Molecular Building Block Synthetic Route
![[Dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP](η3-2-propen-1-yl)palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1) structure diagram](https://xchemchain-prod-1253699568.cos.ap-guangzhou.myqcloud.com/production/attachments/2026/07/22/y4h4/1798782-09-8.png?X-Amz-Algorithm=AWS4-HMAC-SHA256&X-Amz-Credential=AKIDT0SoARehYSEnT2RxQiomY7TcckkZDlIx%2F20260801%2Fap-guangzhou%2Fs3%2Faws4_request&X-Amz-Date=20260801T132653Z&X-Amz-Expires=86400&X-Amz-SignedHeaders=host&response-content-disposition=attachment%3B%20filename%3D%221798782-09-8.png%22&x-id=GetObject&X-Amz-Signature=ddd292b10183e4c71f4b23ebcb413cb6cc726ed672bfb11beb0e96e1afe974c9)
[Dicyclohexyl[3,6-dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']phosphine-κP](η3-2-propen-1-yl)palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1)
![[(1,2,3-Η)-2-buten-1-yl][[3,6-dimethoxy-2′,4′,6′-tris(1-methylethyl)[1,1′-biphenyl]-2-yl-κC1′]bis(1,1-dimethylethyl)phosphine-κP]-Palladium structure diagram](/images/productimg/no-pic.svg)
[(1,2,3-Η)-2-buten-1-yl][[3,6-dimethoxy-2′,4′,6′-tris(1-methylethyl)[1,1′-biphenyl]-2-yl-κC1′]bis(1,1-dimethylethyl)phosphine-κP]-Palladium
[[3,6-Dimethoxy-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl-κC1']bis(1,1-dimethylethyl)phosphine-κP](η3-2-propen-1-yl)-Palladium(1+), 1,1,1-trifluoromethanesulfonate (1:1)