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CAS 34622-08-7 Neodymium(III) Trifluoromethanesulfonate molecular structure lightbox
CAS RN: 34622-08-7

Neodymium(III) Trifluoromethanesulfonate

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260106 100g In stock Inquiry
Batchno.20250711 25g In stock Inquiry
Batchno.20250802 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250123 100g In stock Shanghai Inquiry
Batchno.20260525 25g In stock Shanghai, Tianjin Inquiry
Batchno.20250222 5g In stock Shanghai Inquiry
  • Product code: ICTT1919
  • Purity/Analytical Methods: >97.0%(T)
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34622-08-7 / neodymium(3+);tris(trifluoromethanesulfonate)

Standard CAS: 34622-08-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34622-08-7
Multi CAS
Yes
Molecular Formula
C3F9NDO9S3
Molecular Weight
591.500000
Exact Mass
588.763800
InChI
InChI=1S/3CHF3O3S.Nd/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3
InChIKey
WYRSPTDNOIZOGA-UHFFFAOYSA-K

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
1
H-bond acceptors
9
Molar refractivity
47.26
TPSA
171.6

LogP / Solubility

WLOGP
0.15
MLOGP
0.18
XLogP3
0.15
Consensus LogP
0.16
Log S (ESOL)
-3.6
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.52
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-3.63
Class (SILICOS-IT)
Poorly 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)
-6.22

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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