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CAS 17437-22-8 Hexadecanoic acid, 16-amino- molecular structure lightbox
CAS RN: 17437-22-8

Hexadecanoic acid, 16-amino-

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250513 100mg In stock Shanghai, Shandong Inquiry
  • Product code: SSC-076506
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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: ≥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 17437-22-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

17437-22-8 / 16-aminohexadecanoic acid

Standard CAS: 17437-22-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
17437-22-8
Multi CAS
No
Molecular Formula
C16H33NO2
Molecular Weight
271.440000
Exact Mass
271.251129
SMILES
C(CCCCCCCC(=O)O)CCCCCCCN
InChI
InChI=1S/C16H33NO2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h1-15,17H2,(H,18,19)
InChIKey
QJGFZBNNVXTCLL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.94
Rotatable bonds
15
H-bond acceptors
2
H-bond donors
2
Molar refractivity
81.33
TPSA
63.32

LogP / Solubility

WLOGP
4.49
MLOGP
3.96
XLogP3
1.7
Consensus LogP
3.38
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.03
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.95
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.19

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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