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CAS 107264-00-6 1-FLUORO-2,4,6-TRIMETHYLPYRIDINIUM TRIFLATE molecular structure lightbox
CAS RN: 107264-00-6

1-FLUORO-2,4,6-TRIMETHYLPYRIDINIUM TRIFLATE

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260626 100g In stock Shanghai, Tianjin Inquiry
Batchno.20251201 100mg In stock Shanghai, Tianjin Inquiry
Batchno.20250201 1g In stock Shenzhen, Tianjin Inquiry
Batchno.20260110 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20260110 25g In stock Shanghai, Tianjin Inquiry
Batchno.20250626 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-008726
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 5g, 10g, 25g, 0.1g
  • Available purity: 85+%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 107264-00-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g 85+% 5 In Stock Hong Kong Inquiry
1g 85+% 5 In Stock Hong Kong Inquiry
5g 85+% 5 In Stock Beijing Inquiry
10g 85+% 5 In Stock Shenzhen Inquiry
25g 85+% 4 In Stock Beijing Inquiry
0.1g 85+% 2 In Stock Shenzhen Inquiry

107264-00-6 / 1-fluoro-2,4,6-trimethylpyridin-1-ium;trifluoromethanesulfonate

1-fluoro-2,4,6-trimethylpyridinium trifluoromethanesulfonate [fluorinating reagent] | 1-Fluoro-2,4,6-trimethylpyridinium Trifluoromethanesulfonate (Fluorinating Reagent) | RefChem:432754

Standard CAS: 107264-00-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
107264-00-6
Multi CAS
No
Molecular Formula
C9H11F4NO3S
Molecular Weight
289.250000
Exact Mass
289.039577
SMILES
CC1=CC(=[N+](C(=C1)C)F)C.C(F)(F)(F)S(=O)(=O)[O-]
InChI
InChI=1S/C8H11FN.CHF3O3S/c1-6-4-7(2)10(9)8(3)5-6;2-1(3,4)8(5,6)7/h4-5H,1-3H3;(H,5,6,7)/q+1;/p-1
InChIKey
PRIGFEJKMMRJSF-UHFFFAOYSA-M
Synonyms
1-fluoro-2,4,6-trimethylpyridinium trifluoromethanesulfonate [fluorinating reagent] 1-Fluoro-2,4,6-trimethylpyridinium Trifluoromethanesulfonate (Fluorinating Reagent) RefChem:432754 672-581-4 1-Fluoro-2,4,6-trimethylpyridinium triflate

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.44
H-bond acceptors
3
Molar refractivity
53.11
TPSA
61.08

LogP / Solubility

WLOGP
1.68
MLOGP
1.49
XLogP3
1.68
Consensus LogP
1.62
Log S (ESOL)
-2.94
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.15
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.94
Class (SILICOS-IT)
Moderately 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)
-3.29

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

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

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