![CAS 850444-36-9 (S)-(+)-[(S)-2-Diphenylphosphinoferrocenyl] (N,N-dimethylamino) (2-diphenylphosphinophenyl)methane, min. 97% TANIAPHOS molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/850444-36-9.gif)
CAS RN: 850444-36-9
(S)-(+)-[(S)-2-Diphenylphosphinoferrocenyl] (N,N-dimethylamino) (2-diphenylphosphinophenyl)methane, min. 97% TANIAPHOS
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260315 | 100mg | In stock | Shenzhen, Wuhan | Inquiry | |
| Batchno.20260124 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250102 | 250mg | In stock | Shanghai, Chengdu | Inquiry | |
| Batchno.20250521 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250922 | 50mg / 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250323 | 5g | Out of stock | Inquiry |
- Product code: SSC-192968
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
850444-36-9 / (S)-(+)-[(S)-2-Diphenylphosphinoferrocenyl] (N,N-dimethylamino) (2-diphenylphosphinophenyl)methane, min. 97% TANIAPHOS
Basic Information
CAS
850444-36-9
Multi CAS
Yes
Molecular Formula
C43H39FENP2
Molecular Weight
687.600000
Exact Mass
687.190710
InChI
InChI=1S/C38H34NP2.C5H5.Fe/c1-39(2)38(36-27-16-28-37(36)41(33-22-11-5-12-23-33)34-24-13-6-14-25-34)30-17-15-26-35(29-30)40(31-18-7-3-8-19-31)32-20-9-4-10-21-32;1-2-4-5-3-1;/h3-29,38H,1-2H3;1-5H;/t38-;;/m0../s1
InChIKey
RVZGJYVRGUPFAP-ZCLNGFLVSA-N
Computed Properties
Structural Parameters
Heavy atom count
47
Aromatic heavy atom count
30
Fraction Csp3
0.07
Rotatable bonds
9
H-bond acceptors
1
Molar refractivity
201.53
TPSA
3.24
LogP / Solubility
WLOGP
7.93
MLOGP
7.04
XLogP3
7.93
Consensus LogP
7.63
Log S (ESOL)
-8.98
Class (ESOL)
Insoluble
Log S (Ali)
-10.93
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.79
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.28
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
6.5
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