Dotap structure

Dotap

TL;DR: Dotap (CAS 113669-21-9) is a chemical compound with molecular formula C42H80NO4+ and molecular weight 662.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl-trimethylazanium

Also Known As: DOTAP, Lipofectin, 1,2-Dotap, Dotap chloride, DOTMA

CAS: 113669-21-9
Molecular Formula C42H80NO4+
Molecular Weight 662.61 g/mol
LogP 12.2226
Topological Polar Surface Area 52.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 35
Exact Mass 662.60876
Heavy Atoms 47
Complexity 754.2158

Chemical Identifiers

CAS Number 113669-21-9
SMILES CCCCCCCC/C=C\CCCCCCCC(=O)OCC(C[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC

Product Overview

Dotap (CAS 113669-21-9), with molecular formula C42H80NO4+ and molecular weight 662.61 g/mol. IUPAC: 2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl-trimethylazanium.

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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.
View MSDS →

Chemical Property Profile of Dotap

XLogP
12.2226
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
35
Heavy Atoms
47
Complexity
754.2158
Exact Mass
662.60876
Monoisotopic Mass
662.60876
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 Dotap

The XLogP value of 12.2226 indicates that Dotap is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dotap exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dotap has 0 hydrogen bond donor(s) and 4 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 Dotap?

The CAS number of Dotap is 113669-21-9.

What is the molecular formula of Dotap?

The molecular formula of Dotap is C42H80NO4+.

What is the molecular weight of Dotap?

The molecular weight of Dotap is 662.61 g/mol.

Where can I buy Dotap?

You can request a quote for Dotap directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Dotap?

Yes, KEHONG BIO provides custom synthesis services for Dotap and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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