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CAS 261356-49-4 Potassium Tetracyanoborate molecular structure lightbox
CAS RN: 261356-49-4

Potassium Tetracyanoborate

  • Product code: SSC-123091
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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 261356-49-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

261356-49-4 / potassium tetracyanoboranuide

Standard CAS: 261356-49-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
261356-49-4
Multi CAS
No
Molecular Formula
C4BKN4
Molecular Weight
153.980000
Exact Mass
153.985308
SMILES
[B-](C#N)(C#N)(C#N)C#N.[K+]
InChI
InChI=1S/C4BN4.K/c6-1-5(2-7,3-8)4-9;/q-1;+1
InChIKey
SQFZXQOCCKUPEC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
H-bond acceptors
4
Molar refractivity
28.21
TPSA
95.16

LogP / Solubility

WLOGP
-3.31
MLOGP
-2.92
XLogP3
-3.31
Consensus LogP
-3.18
Log S (ESOL)
1.29
Class (ESOL)
Highly soluble
Log S (Ali)
1.57
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.09
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-6.01

Drug-likeness / Medicinal Chemistry

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

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