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CAS 5353-25-3 2-[(Z)-9-Octadecenyloxy]ethanol molecular structure lightbox
CAS RN: 5353-25-3

2-[(Z)-9-Octadecenyloxy]ethanol

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260102 50mg / 100mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-160886
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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: 0.25g
  • 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 5353-25-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry

5353-25-3 / 2-octadec-9-enoxyethanol

Standard CAS: 5353-25-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5353-25-3
Multi CAS
Yes
Molecular Formula
C20H40O2
Molecular Weight
312.500000
Exact Mass
312.302831
InChI
InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21/h9-10,21H,2-8,11-20H2,1H3/b10-9-
InChIKey
KWVPFECTOKLOBL-KTKRTIGZSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Fraction Csp3
0.9
Rotatable bonds
18
H-bond acceptors
2
H-bond donors
1
Molar refractivity
97.36
TPSA
29.46

LogP / Solubility

WLOGP
6.03
MLOGP
5.32
XLogP3
7.3
Consensus LogP
6.22
Log S (ESOL)
-4.39
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.48
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.86
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)
-0.34

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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