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CAS 841251-37-4 1-Ethyl-3-methylpyridinium Bis(trifluoromethanesulfonyl)imide molecular structure lightbox
CAS RN: 841251-37-4

1-Ethyl-3-methylpyridinium Bis(trifluoromethanesulfonyl)imide

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250601 100g In stock Inquiry
Batchno.20250424 1g In stock Inquiry
Batchno.20260301 25g In stock Inquiry
Batchno.20250913 5g In stock Inquiry
  • Product code: SSC-191706
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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: 5g
  • 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 841251-37-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

841251-37-4 / bis(trifluoromethylsulfonyl)azanide;1-ethyl-3-methylpyridin-1-ium

Standard CAS: 841251-37-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
841251-37-4
Multi CAS
No
Molecular Formula
C10F6H12N2O4S2
Molecular Weight
402.300000
Exact Mass
402.014268
InChI
InChI=1S/C8H12N.C2F6NO4S2/c1-3-9-6-4-5-8(2)7-9;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h4-7H,3H2,1-2H3;/q+1;-1
InChIKey
UZIAGXMMNLATPP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
70.36
TPSA
86.26

LogP / Solubility

WLOGP
2.36
MLOGP
2.1
XLogP3
2.36
Consensus LogP
2.27
Log S (ESOL)
-3.81
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.56
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
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
No
Log Kp (skin permeation)
-3.5

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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