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CAS 15321-51-4 DIIRON NONACARBONYL molecular structure lightbox
CAS RN: 15321-51-4

DIIRON NONACARBONYL

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260623 100g In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batchno.20250729 25g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20250715 500g In stock Shanghai, Shandong Inquiry
Batchno.20250331 5g In stock Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
  • Product code: SSC-062751
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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: 100g
  • 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 15321-51-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g >97% 0 Out of Stock Shenzhen Inquiry

15321-51-4 / carbon monoxide;iron;iron(3+);methanone

Standard CAS: 15321-51-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
15321-51-4
Multi CAS
No
Molecular Formula
C9H3Fe2O9
Molecular Weight
366.800000
Exact Mass
366.847578
SMILES
[CH-]=O.[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+3]
InChI
InChI=1S/3CHO.6CO.2Fe/c9*1-2;;/h3*1H;;;;;;;;/q3*-1;;;;;;;;+3
InChIKey
CGJSNKHFIBINMR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
H-bond acceptors
3
Molar refractivity
43.83
TPSA
170.61

LogP / Solubility

WLOGP
-1.05
MLOGP
-0.91
XLogP3
-1.05
Consensus LogP
-1
Log S (ESOL)
-1.45
Class (ESOL)
Soluble
Log S (Ali)
-1.81
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.17
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.7

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Flammable Acute Toxic
Signal
Danger
GHS Hazard Statements
H228 (97.8%): Flammable solid [Danger Flammable solids] H261 (84.8%): In contact with water releases flammable gas [Danger Substances and mixtures which in contact with water, emit flammable gases] H301+H331 (84.8%): Toxic if swallowed or if inhaled [Danger Acute toxicity, oral; acute toxicity, inhalation] H301 (84.8%): Toxic if swallowed [Danger Acute toxicity, oral] H331 (84.8%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Precautionary Statement Codes
P210, P231+P232, P240, P241, P261, P264, P270, P271, P280, P301+P316, P304+P340, P316, P321, P330, P370+P378, P402+P404, P403+P233, P405, and P501

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