CAS RN: 1256366-05-8
Potassium (t-butylaminomethyl)trifluoroborate
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250325 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: starshine_CAS1256366-05-8
- Purity/Analytical Methods: >99.0%
1256366-05-8 / potassium (tert-butylamino)methyl-trifluoroboranuide
Basic Information
CAS
1256366-05-8
Multi CAS
No
Molecular Formula
C5H12BF3KN
Molecular Weight
193.060000
Exact Mass
193.065196
SMILES
[B-](CNC(C)(C)C)(F)(F)F.[K+]
InChI
InChI=1S/C5H12BF3N.K/c1-5(2,3)10-4-6(7,8)9;/h10H,4H2,1-3H3;/q-1;+1
InChIKey
OCJYVRSNCKUPKA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
36.83
TPSA
12.03
LogP / Solubility
WLOGP
-1.23
MLOGP
-1.09
XLogP3
-1.23
Consensus LogP
-1.18
Log S (ESOL)
-0.13
Class (ESOL)
Very soluble
Log S (Ali)
-0.25
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.13
Class (SILICOS-IT)
Very 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)
-4.77
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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