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2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium structure
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2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium

TL;DR: 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium (CAS 132172-61-3) is a chemical compound with molecular formula C42H80NO4+ and molecular weight 662.60876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,3-di(octadec-9-enoyloxy)propyl-trimethylazanium

Also Known As: Dotap chloride, DOTAP, (+/-)-Dotap chloride, Dotap chloride, (+/-)-, 1,2-Dioleoyl-3-trimethylammonium-propane, Chloride

CAS Number
132172-61-3
Molecular Formula
C42H80NO4+
Molecular Weight
662.60876 g/mol
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Application Areas

Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (139 patents) Analytical Reagents (334 patents) Biotechnology (3957 patents) Catalysts (16 patents) Coatings & Adhesives (3 patents)

Technical Specifications

Molecular FormulaC42H80NO4+
Molecular Weight662.60876 g/mol
XLogP15.1
Topological Polar Surface Area (TPSA)52.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds37
Exact Mass662.60876 Da
Heavy Atoms47
Complexity754.0
SMILESCCCCCCCCC=CCCCCCCCC(=O)OCC(C[N+](C)(C)C)OC(=O)CCCCCCCC=CCCCCCCCC
InChIKeyKWVJHCQQUFDPLU-UHFFFAOYSA-N

Chemical Property Profile of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium

XLogP
15.1
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
37
Heavy Atoms
47
Complexity
754.0
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 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium

The XLogP value of 15.1 indicates that 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium 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 CAS number of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium?

The CAS number of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium is 132172-61-3.

What is the molecular formula of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium?

The molecular formula of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium is C42H80NO4+.

What is the molecular weight of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium?

The molecular weight of 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium is 662.60876 g/mol.

Where can I buy 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium?

You can request a quote for 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium?

Yes, CoreyChem provides custom synthesis services for 2,3-Di(octadec-9-enoyloxy)propyl-trimethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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