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CAS 2566-97-4 Methyl trans,trans-9,12-Octadecadienoate molecular structure lightbox
CAS RN: 2566-97-4

Methyl trans,trans-9,12-Octadecadienoate

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250326 100mg In stock Inquiry
Batchno.20260208 500mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250814 100mg / 250mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251014 100mg In stock Shanghai Inquiry
Batchno.20250604 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251231 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250628 5g Out of stock Inquiry
  • Product code: SSC-121950
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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 2566-97-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

2566-97-4 / methyl octadeca-9,12-dienoate

Standard CAS: 2566-97-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2566-97-4
Multi CAS
No
Molecular Formula
C19H34O2
Molecular Weight
294.500000
Exact Mass
294.255880
SMILES
CCCCCC=CCC=CCCCCCCCC(=O)OC
InChI
InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3
InChIKey
WTTJVINHCBCLGX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
0.74
Rotatable bonds
14
H-bond acceptors
2
Molar refractivity
91.37
TPSA
26.3

LogP / Solubility

WLOGP
5.97
MLOGP
5.27
XLogP3
6.9
Consensus LogP
6.05
Log S (ESOL)
-4.5
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.29
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.21
Class (SILICOS-IT)
Insoluble

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)
-0.28

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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