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CAS 65119-95-1 22-Tricosenoic Acid molecular structure lightbox
CAS RN: 65119-95-1

22-Tricosenoic Acid

  • Product code: SSC-174775
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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: 0.1g, 0.25g, 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 65119-95-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

65119-95-1 / tricos-22-enoic acid

Standard CAS: 65119-95-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
65119-95-1
Multi CAS
No
Molecular Formula
C23H44O2
Molecular Weight
352.600000
Exact Mass
352.334131
InChI
InChI=1S/C23H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2H,1,3-22H2,(H,24,25)
InChIKey
YGTSVJQQDISEHZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
0.87
Rotatable bonds
21
H-bond acceptors
1
H-bond donors
1
Molar refractivity
110.17
TPSA
37.3

LogP / Solubility

WLOGP
8.06
MLOGP
7.11
XLogP3
10.4
Consensus LogP
8.52
Log S (ESOL)
-5.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-8.27
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.16
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)
0.85

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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