![CAS 58086-67-2 2-Fluoro-1-methylpyridinium p-Toluenesulfonate [Fluorinating Reagent] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/f0225-jpgcontextbwfzdgvyfhjvb3r8mzg5mtn8aw1hz2uvanblz3xondivady0lzg5mza2mdqymja0ndyvrjaymjuuanbnfdlkytkwmdy0yji4ymi3ymrknduznddlytllymq5nzzimjkzyjgzztnknty3nmzkzgflnmq2mjnjywq3zmq3mwi.jpeg)
CAS RN: 58086-67-2
2-Fluoro-1-methylpyridinium p-Toluenesulfonate [Fluorinating Reagent]
Product Availability
Choose a grade to view its available package options.
12 package records9 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260313 | 100g | Out of stock | Inquiry | |
| Batchno.20251216 | 100g | In stock | Shandong | Inquiry |
| Batchno.20260124 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20251021 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250117 | 25g | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20250329 | 25g | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250526 | 5g | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20251221 | 5g | In stock | Shanghai, Shandong, Guangdong | Inquiry |
- Product code: SSC-166284
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: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
58086-67-2 / 2-fluoro-1-methylpyridin-1-ium;4-methylbenzenesulfonate
Basic Information
CAS
58086-67-2
Multi CAS
Yes
Molecular Formula
C13FH14NO3S
Molecular Weight
283.320000
Exact Mass
283.067843
InChI
InChI=1S/C7H8O3S.C6H7FN/c1-6-2-4-7(5-3-6)11(8,9)10;1-8-5-3-2-4-6(8)7/h2-5H,1H3,(H,8,9,10);2-5H,1H3/q;+1/p-1
InChIKey
HQWDKLAIDBOLFE-UHFFFAOYSA-M
Physical Properties
Physical Description
White or cream-colored crystalline powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.15
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
66.72
TPSA
61.08
LogP / Solubility
WLOGP
1.55
MLOGP
1.37
XLogP3
1.55
Consensus LogP
1.49
Log S (ESOL)
-2.97
Class (ESOL)
Moderately soluble
Log S (Ali)
-3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.91
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.35
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
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