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CAS 742086-10-8 1-Methylpyridinium Bis(trifluoromethanesulfonyl)imide molecular structure lightbox
CAS RN: 742086-10-8

1-Methylpyridinium Bis(trifluoromethanesulfonyl)imide

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260510 1g In stock Inquiry
Batchno.20260325 200mg In stock Inquiry
Batchno.20251223 250mg Out of stock Inquiry
Batchno.20250821 5g In stock Inquiry
  • Product code: SSC-183658
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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: 10g
  • 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 742086-10-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Beijing Inquiry

742086-10-8 / bis(trifluoromethylsulfonyl)azanide;1-methylpyridin-1-ium

Standard CAS: 742086-10-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
742086-10-8
Multi CAS
Yes
Molecular Formula
C8F6H8N2O4S2
Molecular Weight
374.300000
Exact Mass
373.982968
InChI
InChI=1S/C6H8N.C2F6NO4S2/c1-7-5-3-2-4-6-7;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h2-6H,1H3;/q+1;-1
InChIKey
VBNBBEPGIRSZII-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
60.93
TPSA
86.26

LogP / Solubility

WLOGP
1.57
MLOGP
1.4
XLogP3
1.57
Consensus LogP
1.51
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.76
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
Class (SILICOS-IT)
Poorly 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)
-3.89

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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