CAS RN: 1089208-56-9
Nickel(II) trifluoroacetate
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250724 | 100g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250930 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250102 | 1g / 5g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20260416 | 25g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251030 | 5g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry |
- Product code: starshine_CAS1089208-56-9
- Purity/Analytical Methods: >99.0%
1089208-56-9 / nickel(2+);bis(2,2,2-trifluoroacetate);hexahydrate
Nickel(II) 2,2,2-trifluoroacetate hexahydrate | C4H12F6NiO10 | nickelous;2,2,2-trifluoroacetate;hexahydrate
Basic Information
CAS
1089208-56-9
Multi CAS
No
Molecular Formula
C4H12F6NiO10
Molecular Weight
392.820000
Exact Mass
391.968807
SMILES
C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].O.O.O.O.O.O.[Ni+2]
InChI
InChI=1S/2C2HF3O2.Ni.6H2O/c2*3-2(4,5)1(6)7;;;;;;;/h2*(H,6,7);;6*1H2/q;;+2;;;;;;/p-2
InChIKey
WWEPFRJUKHTUKV-UHFFFAOYSA-L
Synonyms
Nickel(II) 2,2,2-trifluoroacetate hexahydrate
C4H12F6NiO10
nickelous;2,2,2-trifluoroacetate;hexahydrate
F71349
nickel(2+);2,2,2-trifluoroacetate;hexahydrate
Computed Properties
Structural Parameters
Heavy atom count
21
Fraction Csp3
0.5
H-bond acceptors
4
H-bond donors
6
Molar refractivity
43.81
TPSA
269.26
LogP / Solubility
WLOGP
-6.35
MLOGP
-5.57
XLogP3
-6.35
Consensus LogP
-6.09
Log S (ESOL)
1.73
Class (ESOL)
Highly soluble
Log S (Ali)
1.81
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.06
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)
-9.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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