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CAS 62613-15-4 Diphenyliodonium Hexafluoroarsenate molecular structure lightbox
CAS RN: 62613-15-4

Diphenyliodonium Hexafluoroarsenate

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2 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250531 100mg Out of stock Inquiry
Batchno.20250326 250mg Out of stock Inquiry
  • Product code: ICTD2248
  • Purity/Analytical Methods: >98.0%(T)
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62613-15-4 / arsenic(5+);diphenyliodanium;hexafluoride

Standard CAS: 62613-15-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
62613-15-4
Multi CAS
Yes
Molecular Formula
AsC12F6H10I
Molecular Weight
470.020000
Exact Mass
469.894740
InChI
InChI=1S/C12H10I.As.6FH/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;;;;/h1-10H;;6*1H/q+1;+5;;;;;;/p-6
InChIKey
ABPJIMXUCFBSRQ-UHFFFAOYSA-H

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
6
Molar refractivity
56.03
TPSA
0.0000

LogP / Solubility

WLOGP
-18.54
MLOGP
-16.28
XLogP3
-18.54
Consensus LogP
-17.79
Log S (ESOL)
8.62
Class (ESOL)
Highly soluble
Log S (Ali)
9.97
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
12.43
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)
-18.75

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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