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CAS 63922-84-9 (2-Trimethylsilylethyl)triphenylphosphonium Iodide molecular structure lightbox
CAS RN: 63922-84-9

(2-Trimethylsilylethyl)triphenylphosphonium Iodide

  • Product code: SSC-173717
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ＞95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 63922-84-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Beijing Inquiry

63922-84-9 / triphenyl(2-trimethylsilylethyl)phosphanium iodide

Standard CAS: 63922-84-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
63922-84-9
Multi CAS
Yes
Molecular Formula
C23H28IPSi
Molecular Weight
490.400000
Exact Mass
490.074260
InChI
InChI=1S/C23H28PSi.HI/c1-25(2,3)20-19-24(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23;/h4-18H,19-20H2,1-3H3;1H/q+1;/p-1
InChIKey
NXZYPOSEOPBJMW-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
18
Fraction Csp3
0.22
Rotatable bonds
6
H-bond acceptors
1
Molar refractivity
118.17
TPSA
0.0000

LogP / Solubility

WLOGP
2.32
MLOGP
2.08
XLogP3
2.32
Consensus LogP
2.24
Log S (ESOL)
-4.46
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.26
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.5
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.06

Drug-likeness / Medicinal Chemistry

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

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