![CAS 895541-38-5 Rhodium(1+), [(1,2,5,6-η)-1,5-cyclooctadiene][(2R,2’R,5R,5’R)-1,1′-(1,2-ethanediyl)bis[2,5-bis(1-methylethyl)phospholane-κP]]-, tetrafluoroborate(1-) (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/895541-38-5.gif)
CAS RN: 895541-38-5
Rhodium(1+), [(1,2,5,6-η)-1,5-cyclooctadiene][(2R,2’R,5R,5’R)-1,1′-(1,2-ethanediyl)bis[2,5-bis(1-methylethyl)phospholane-κP]]-, tetrafluoroborate(1-) (9CI)
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260128 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250711 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260621 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251104 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250927 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS895541-38-5
- Purity/Analytical Methods: >99.0%
895541-38-5 / cycloocta-1,5-diyne;(2R,5R)-1-[2-[(2R,5R)-2,5-di(propan-2-yl)phospholan-1-ium-1-yl]ethyl]-2,5-di(propan-2-yl)phospholan-1-ium;rhodium;tetrafluoroborate
Basic Information
CAS
895541-38-5
Multi CAS
Yes
Molecular Formula
BC30F4H54P2Rh
Molecular Weight
666.400000
Exact Mass
666.278490
InChI
InChI=1S/C22H44P2.C8H12.BF4.Rh/c1-15(2)19-9-10-20(16(3)4)23(19)13-14-24-21(17(5)6)11-12-22(24)18(7)8;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h15-22H,9-14H2,1-8H3;1-2,7-8H,3-6H2;;/q;;-1;/b;2-1-,8-7?;;/t19-,20-,21-,22-;;;/m1.../s1
InChIKey
NRQFPKPBTSPMQF-BLYWAKBCSA-N
Computed Properties
Structural Parameters
Heavy atom count
38
Fraction Csp3
0.87
Rotatable bonds
7
H-bond acceptors
5
Molar refractivity
163.54
TPSA
0.0000
LogP / Solubility
WLOGP
9.97
MLOGP
8.83
XLogP3
9.97
Consensus LogP
9.59
Log S (ESOL)
-9.79
Class (ESOL)
Insoluble
Log S (Ali)
-12.22
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.1
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.29
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
6
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