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CAS 22941-53-3 Hexacarbonyldi(chloro)dichlorodiruthenium(II) molecular structure lightbox
CAS RN: 22941-53-3

Hexacarbonyldi(chloro)dichlorodiruthenium(II)

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250702 100mg In stock Shanghai Inquiry
Batchno.20250516 1g In stock Shanghai Inquiry
Batchno.20250603 250mg In stock Shanghai Inquiry
  • Product code: SSC-111578
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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 22941-53-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

22941-53-3 / carbon monoxide;bis(dichlororuthenium(2+))

Standard CAS: 22941-53-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22941-53-3
Multi CAS
No
Molecular Formula
C6Cl4O6Ru2+4
Molecular Weight
512.000000
Exact Mass
515.651710
SMILES
[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Ru+2]Cl.Cl[Ru+2]Cl
InChI
InChI=1S/6CO.4ClH.2Ru/c6*1-2;;;;;;/h;;;;;;4*1H;;/q;;;;;;;;;;+1;+2/p-2
InChIKey
DPIPVAFWAOBRIT-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
18
H-bond acceptors
6
Molar refractivity
46.99
TPSA
119.4

LogP / Solubility

WLOGP
2.53
MLOGP
2.26
XLogP3
2.53
Consensus LogP
2.44
Log S (ESOL)
-4.61
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.09
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.05

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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