Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) structure

Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)

TL;DR: Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) (CAS 17329-61-2) is a chemical compound with molecular formula C26H53NO6 and molecular weight 475.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

acetic acid;2-[bis(2-hydroxyethyl)amino]ethyl octadecanoate

Also Known As: Triethanolamine stearate acetate salt, bis(2-hydroxyethyl)[2-(stearoyloxy)ethyl]ammonium acetate, Triethanolamine, stearic acid monoester, acetate salt, acetic acid;2-[bis(2-hydroxyethyl)amino]ethyl octadecanoate, Octadecanoic acid, 2-(bis(2-hydroxyethyl)amino)ethyl ester, acetate (1:1)

CAS: 17329-61-2
Molecular Formula C26H53NO6
Molecular Weight 475.39 g/mol
LogP 5.17
Topological Polar Surface Area 107.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 7
Rotatable Bonds 24
Exact Mass 475.3873
Heavy Atoms 33
Complexity 364.0

Chemical Identifiers

CAS Number 17329-61-2
SMILES CCCCCCCCCCCCCCCCCC(=O)OCCN(CCO)CCO.CC(=O)O
InChIKey SKADIAAODVDROI-UHFFFAOYSA-N

Product Overview

Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) (CAS 17329-61-2), with molecular formula C26H53NO6 and molecular weight 475.39 g/mol. IUPAC: acetic acid;2-[bis(2-hydroxyethyl)amino]ethyl octadecanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)

XLogP
5.17
TPSA (Topological Polar Surface Area)
107.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
7
Rotatable Bonds
24
Heavy Atoms
33
Complexity
364.0
Exact Mass
475.3873
Monoisotopic Mass
475.3873
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)

The XLogP value of 5.17 indicates that Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1). Following Lipinski's Rule of Five, Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)?

The CAS number of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) is 17329-61-2.

What is the molecular formula of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)?

The molecular formula of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) is C26H53NO6.

What is the molecular weight of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)?

The molecular weight of Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) is 475.39 g/mol.

Where can I buy Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)?

You can request a quote for Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1)?

Yes, KEHONG BIO provides custom synthesis services for Octadecanoic acid, 2-[bis(2-hydroxyethyl)amino]ethyl ester, acetate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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