CAS RN: 849950-56-7

[Rh COD (R)-Phanephos]BF4

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250809 100mg In stock Shanghai Inquiry
Batchno.20250331 1g In stock Shanghai Inquiry
Batchno.20250424 250mg In stock Shanghai Inquiry
Batchno.20251128 500mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-192808
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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: >95%
  • 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 849950-56-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Hong Kong Inquiry

849950-56-7 / cycloocta-1,5-diene;(11-diphenylphosphanyl-5-tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaenyl)-diphenylphosphane;rhodium;tetrafluoroborate

Standard CAS: 849950-56-7 Multi CAS: Yes

Basic Information

CAS
849950-56-7
Multi CAS
Yes
Molecular Formula
BC48F4H46P2Rh
Molecular Weight
874.500000
Exact Mass
874.215890
InChI
InChI=1S/C40H34P2.C8H12.BF4.Rh/c1-5-13-35(14-6-1)41(36-15-7-2-8-16-36)39-29-31-21-25-33(39)27-23-32-22-26-34(28-24-31)40(30-32)42(37-17-9-3-10-18-37)38-19-11-4-12-20-38;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h1-22,25-26,29-30H,23-24,27-28H2;1-2,7-8H,3-6H2;;/q;;-1;/b;2-1-,8-7-;;
InChIKey
OBYSVBUVKOIHEY-ONEVTFJLSA-N

Computed Properties

Structural Parameters

Heavy atom count
56
Aromatic heavy atom count
36
Fraction Csp3
0.17
Rotatable bonds
6
H-bond acceptors
5
Molar refractivity
232.05
TPSA
0.0000

LogP / Solubility

WLOGP
11.06
MLOGP
9.81
XLogP3
11.06
Consensus LogP
10.64
Log S (ESOL)
-12.31
Class (ESOL)
Insoluble
Log S (Ali)
-14.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.24
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)
-0.2

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
10

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