CAS RN: 12145-47-0

DibroMo(1,5-cyclooctadiene)palladiuM(II)

Product Availability

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7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250706 100mg In stock Inquiry
Batchno.20260701 1g In stock Inquiry
Batchno.20250421 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260224 100mg In stock Shanghai Inquiry
Batchno.20250219 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260316 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20251007 5g In stock Shanghai Inquiry
  • Product code: SSC-023921
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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 12145-47-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 0 Out of Stock Hong Kong Inquiry

12145-47-0 / (1Z,5Z)-cycloocta-1,5-diene;dibromopalladium

Standard CAS: 12145-47-0 Multi CAS: No

Basic Information

CAS
12145-47-0
Multi CAS
No
Molecular Formula
C8H12Br2Pd
Molecular Weight
374.410000
Exact Mass
373.832010
SMILES
C1/C=C\CC/C=C\C1.Br[Pd]Br
InChI
InChI=1S/C8H12.2BrH.Pd/c1-2-4-6-8-7-5-3-1;;;/h1-2,7-8H,3-6H2;2*1H;/q;;;+2/p-2/b2-1-,8-7-;;;
InChIKey
VDWGPWKGFNEZFD-PHFPKPIQSA-L

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.5
Molar refractivity
54.6
TPSA
0.0000

LogP / Solubility

WLOGP
4.36
MLOGP
3.86
XLogP3
4.36
Consensus LogP
4.19
Log S (ESOL)
-4.91
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.78
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.71
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-1.91

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (97.4%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (97.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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