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CAS 851308-41-3 (S)-1-{(R)-2-[DI(1-NAPHTHYL)PHOSPHINO]FERROCENYL}ETHYLDI(3,5-XYLYL)PHOSPHINE molecular structure lightbox
CAS RN: 851308-41-3

(S)-1-{(R)-2-[DI(1-NAPHTHYL)PHOSPHINO]FERROCENYL}ETHYLDI(3,5-XYLYL)PHOSPHINE

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260409 100mg In stock Shenzhen, Tianjin Inquiry
Batchno.20250326 1g In stock Tianjin, Chengdu Inquiry
Batchno.20251213 250mg In stock Chengdu Inquiry
Batchno.20250308 50mg In stock Shanghai, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250829 50mg / 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-193256
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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
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 851308-41-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

851308-41-3 / (S)-1-{(R)-2-[DI(1-NAPHTHYL)PHOSPHINO]FERROCENYL}ETHYLDI(3,5-XYLYL)PHOSPHINE

Standard CAS: 851308-41-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
851308-41-3
Multi CAS
Yes
Molecular Formula
C48H44FEP2
Molecular Weight
738.700000
Exact Mass
738.226761
InChI
InChI=1S/C43H39P2.C5H5.Fe/c1-29-23-30(2)26-36(25-29)44(37-27-31(3)24-32(4)28-37)33(5)38-19-12-22-41(38)45(42-20-10-15-34-13-6-8-17-39(34)42)43-21-11-16-35-14-7-9-18-40(35)43;1-2-4-5-3-1;/h6-28,33H,1-5H3;1-5H;/t33-;;/m0../s1
InChIKey
NODPGYHIGOCWSG-NYPSMHOZSA-N

Computed Properties

Structural Parameters

Heavy atom count
51
Aromatic heavy atom count
32
Fraction Csp3
0.12
Rotatable bonds
7
Molar refractivity
224.61
TPSA
0.0000

LogP / Solubility

WLOGP
11.52
MLOGP
10.21
XLogP3
11.52
Consensus LogP
11.08
Log S (ESOL)
-11.68
Class (ESOL)
Insoluble
Log S (Ali)
-13.94
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-14.87
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)
0.96

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
7

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