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CAS 7773-83-3 1-Docosanethiol molecular structure lightbox
CAS RN: 7773-83-3

1-Docosanethiol

Product Availability

Choose a grade to view its available package options.

8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250502 1g In stock Inquiry
Batchno.20250421 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251031 100mg In stock Shanghai Inquiry
Batchno.20260220 10g In stock Shanghai, Tianjin Inquiry
Batchno.20260519 1g In stock Shanghai Inquiry
Batchno.20260606 250mg In stock Shanghai Inquiry
Batchno.20251016 25g In stock Shanghai Inquiry
Batchno.20251202 5g In stock Shanghai Inquiry
  • Product code: SSC-187251
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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: 5g
  • Available purity: ≥98%
  • 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 7773-83-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Shanghai Inquiry

7773-83-3 / docosane-1-thiol

Standard CAS: 7773-83-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7773-83-3
Multi CAS
Yes
Molecular Formula
C22H46S
Molecular Weight
342.700000
Exact Mass
342.332023
InChI
InChI=1S/C22H46S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3
InChIKey
NNZMLOHQRXHPOZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Fraction Csp3
1
Rotatable bonds
20
H-bond acceptors
1
H-bond donors
1
Molar refractivity
111.87
TPSA
1.0000

LogP / Solubility

WLOGP
8.74
MLOGP
7.71
XLogP3
11.5
Consensus LogP
9.32
Log S (ESOL)
-6.15
Class (ESOL)
Insoluble
Log S (Ali)
-8.68
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.54
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
1.39

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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