CAS RN: 168106-26-1

Lanthanum(III) Bis(trifluoromethanesulfonyl)imide

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7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260304 1g In stock Shanghai, Guangdong Inquiry
Batchno.20250529 250mg In stock Shanghai, Guangdong, Chongqing Inquiry
Batchno.20250507 5g In stock Shanghai Inquiry
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Batchno.20250201 1g In stock Shanghai Inquiry
Batchno.20250712 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20251225 25g Out of stock Inquiry
Batchno.20251022 5g In stock Shanghai Inquiry
  • Product code: ICTL0294
  • Purity/Analytical Methods: >98.0%(T)
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168106-26-1 / tris(bis(trifluoromethylsulfonyl)azanide);lanthanum(3+)

Standard CAS: 168106-26-1 Multi CAS: No

Basic Information

CAS
168106-26-1
Multi CAS
No
Molecular Formula
C6F18LaN3O12S6
Molecular Weight
979.400000
Exact Mass
978.658244
SMILES
C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.[La+3]
InChI
InChI=1S/3C2F6NO4S2.La/c3*3-1(4,5)14(10,11)9-15(12,13)2(6,7)8;/q3*-1;+3
InChIKey
XQHMUWQUZHVCJH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
46
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
12
Molar refractivity
99.93
TPSA
247.14

LogP / Solubility

WLOGP
3.18
MLOGP
2.89
XLogP3
3.18
Consensus LogP
3.08
Log S (ESOL)
-7.52
Class (ESOL)
Insoluble
Log S (Ali)
-9.89
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.38
Class (SILICOS-IT)
Insoluble

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
Yes
Log Kp (skin permeation)
-6.44

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
4

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501

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