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CAS 623580-02-9 1-Butyl-1-methylpiperidinium Bis(trifluoromethanesulfonyl)imide molecular structure lightbox
CAS RN: 623580-02-9

1-Butyl-1-methylpiperidinium Bis(trifluoromethanesulfonyl)imide

Product Availability

Choose a grade to view its available package options.

10 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260303 100g Out of stock Inquiry
Batchno.20250409 1g In stock Inquiry
Batchno.20250703 25g In stock Inquiry
Batchno.20250113 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251029 100g In stock Shanghai Inquiry
Batchno.20260201 1g In stock Shanghai, Shandong Inquiry
Batchno.20251125 25g In stock Shanghai, Guangdong, Hebei Inquiry
Batchno.20250904 5g In stock Shanghai, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250414 1g In stock Shanghai Inquiry
Batchno.20251027 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-171500
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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: 25g
  • Available purity: ≥98%
  • 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 623580-02-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 0 Out of Stock Beijing Inquiry

623580-02-9 / bis(trifluoromethylsulfonyl)azanide;1-butyl-1-methylpiperidin-1-ium

Standard CAS: 623580-02-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
623580-02-9
Multi CAS
Yes
Molecular Formula
C12F6H22N2O4S2
Molecular Weight
436.400000
Exact Mass
436.092519
InChI
InChI=1S/C10H22N.C2F6NO4S2/c1-3-4-8-11(2)9-6-5-7-10-11;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-10H2,1-2H3;/q+1;-1
InChIKey
ZDMWZUAOSLBMEY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
4
Molar refractivity
82.85
TPSA
82.38

LogP / Solubility

WLOGP
3.48
MLOGP
3.09
XLogP3
3.48
Consensus LogP
3.35
Log S (ESOL)
-4.41
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.65
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.98
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)
-2.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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