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CAS 145022-44-2 1-Ethyl-3-methylimidazolium Trifluoromethanesulfonate molecular structure lightbox
CAS RN: 145022-44-2

1-Ethyl-3-methylimidazolium Trifluoromethanesulfonate

Product Availability

Choose a grade to view its available package options.

10 package records10 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251123 100g In stock Inquiry
Batchno.20260114 1g In stock Inquiry
Batchno.20260216 25g In stock Inquiry
Batchno.20260609 500g In stock Inquiry
Batchno.20260601 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260312 100g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20250810 1g In stock Shanghai, Shandong, Chongqing Inquiry
Batchno.20250920 25g In stock Shandong Inquiry
Batchno.20260128 500g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20251018 5g In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
  • Product code: SSC-056397
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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 145022-44-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shanghai Inquiry

145022-44-2 / 1-ethyl-3-methylimidazol-3-ium;trifluoromethanesulfonate

Standard CAS: 145022-44-2 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
145022-44-2
Multi CAS
No
Molecular Formula
C7H11F3N2O3S
Molecular Weight
260.240000
Exact Mass
260.044248
SMILES
CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]
InChI
InChI=1S/C6H11N2.CHF3O3S/c1-3-8-5-4-7(2)6-8;2-1(3,4)8(5,6)7/h4-6H,3H2,1-2H3;(H,5,6,7)/q+1;/p-1
InChIKey
ZPTRYWVRCNOTAS-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
47.03
TPSA
66.01

LogP / Solubility

WLOGP
0.38
MLOGP
0.35
XLogP3
0.38
Consensus LogP
0.37
Log S (ESOL)
-1.86
Class (ESOL)
Soluble
Log S (Ali)
-1.97
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.03

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 107 of 115 companies (only 7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

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