![CAS 854019-82-2 (R)-1-[(S)-2-(Dicyclohexylphosphino)ferrocenyl]ethyldi-tert-butylphosphine palladium(Ⅱ) dichloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/854019-82-2.gif)
CAS RN: 854019-82-2
(R)-1-[(S)-2-(Dicyclohexylphosphino)ferrocenyl]ethyldi-tert-butylphosphine palladium(Ⅱ) dichloride
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250614 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250927 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20260102 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260609 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260624 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS854019-82-2
- Purity/Analytical Methods: >99.0%
854019-82-2 / cyclopenta-1,3-diene;ditert-butyl-[(1R)-1-(2-dicyclohexylphosphanylcyclopenta-2,4-dien-1-yl)ethyl]phosphane;dichloropalladium;iron(2+)
Basic Information
CAS
854019-82-2
Multi CAS
Yes
Molecular Formula
C32H52CL2FEP2PD
Molecular Weight
731.900000
Exact Mass
730.130550
InChI
InChI=1S/C27H47P2.C5H5.2ClH.Fe.Pd/c1-21(29(26(2,3)4)27(5,6)7)24-19-14-20-25(24)28(22-15-10-8-11-16-22)23-17-12-9-13-18-23;1-2-4-5-3-1;;;;/h14,19-23H,8-13,15-18H2,1-7H3;1-5H;2*1H;;/q2*-1;;;2*+2/p-2/t21-;;;;;/m1...../s1
InChIKey
XAYLYDUFNJVBCE-RPDSBUJNSA-L
Computed Properties
Structural Parameters
Heavy atom count
38
Aromatic heavy atom count
10
Fraction Csp3
0.69
Rotatable bonds
5
H-bond acceptors
2
Molar refractivity
170.92
TPSA
0.0000
LogP / Solubility
WLOGP
12.1
MLOGP
10.71
XLogP3
12.1
Consensus LogP
11.64
Log S (ESOL)
-11.86
Class (ESOL)
Insoluble
Log S (Ali)
-14.3
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.06
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.4
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
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