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CAS 411206-75-2 POTASSIUM (3-CHLOROPHENYL)TRIFLUOROBORATE molecular structure lightbox
CAS RN: 411206-75-2

POTASSIUM (3-CHLOROPHENYL)TRIFLUOROBORATE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250912 1g In stock Shanghai Inquiry
Batchno.20251206 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250515 25g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250610 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-149529
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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: 1g
  • 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 411206-75-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

411206-75-2 / potassium (3-chlorophenyl)-trifluoroboranuide

Standard CAS: 411206-75-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
411206-75-2
Multi CAS
Yes
Molecular Formula
C6H4BCLF3K
Molecular Weight
218.450000
Exact Mass
217.968374
InChI
InChI=1S/C6H4BClF3.K/c8-6-3-1-2-5(4-6)7(9,10)11;/h1-4H;/q-1;+1
InChIKey
LRJCVRYGKNDLAD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
40.16
TPSA
0.0000

LogP / Solubility

WLOGP
-0.6
MLOGP
-0.53
XLogP3
-0.6
Consensus LogP
-0.58
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-0.92
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.7
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-4.48

Drug-likeness / Medicinal Chemistry

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

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