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CAS 506-45-6 22-Hydroxydocosanoic acid (Omega-Hydroxybehenic acid) molecular structure lightbox
CAS RN: 506-45-6

22-Hydroxydocosanoic acid (Omega-Hydroxybehenic acid)

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250416 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250218 250mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20251114 25g In stock Shanghai Inquiry
Batchno.20260401 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-157199
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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: ≥97%
  • 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 506-45-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Shenzhen Inquiry

506-45-6 / 22-hydroxydocosanoic acid

Standard CAS: 506-45-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
506-45-6
Multi CAS
No
Molecular Formula
C22H44O3
Molecular Weight
356.600000
Exact Mass
356.329045
InChI
InChI=1S/C22H44O3/c23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22(24)25/h23H,1-21H2,(H,24,25)
InChIKey
IBPVZXPSTLXWCG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
0.95
Rotatable bonds
21
H-bond acceptors
2
H-bond donors
2
Molar refractivity
107.06
TPSA
57.53

LogP / Solubility

WLOGP
6.87
MLOGP
6.06
XLogP3
7.5
Consensus LogP
6.81
Log S (ESOL)
-4.99
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.44
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.2
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
Yes
Log Kp (skin permeation)
-0.02

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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