Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate structure

Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate

TL;DR: Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate (CAS 29980-17-4) is a chemical compound with molecular formula C45H89N3O6S and molecular weight 799.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate

Also Known As: dimethyl-bis[3-[[(Z)-octadec-9-enoyl]amino]propyl]azanium; sulfonatooxymethane

CAS: 29980-17-4
Molecular Formula C45H89N3O6S
Molecular Weight 799.65 g/mol
LogP 11.2434
Topological Polar Surface Area 124.63 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 39
Exact Mass 799.6472
Heavy Atoms 55
Complexity 954.0852

Chemical Identifiers

CAS Number 29980-17-4
SMILES CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(C)CCCNC(=O)CCCCCCCC=CCCCCCCCC.COS(=O)(=O)[O-]

Product Overview

Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate (CAS 29980-17-4), with molecular formula C45H89N3O6S and molecular weight 799.65 g/mol. IUPAC: dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate.

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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 Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate

XLogP
11.2434
TPSA (Topological Polar Surface Area)
124.63
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
39
Heavy Atoms
55
Complexity
954.0852
Exact Mass
799.6472
Monoisotopic Mass
799.6472
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 Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate

The XLogP value of 11.2434 indicates that Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate. Following Lipinski's Rule of Five, Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate has 2 hydrogen bond donor(s) and 6 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 Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate?

The CAS number of Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate is 29980-17-4.

What is the molecular formula of Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate?

The molecular formula of Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate is C45H89N3O6S.

What is the molecular weight of Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate?

The molecular weight of Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate is 799.65 g/mol.

Where can I buy Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate?

You can request a quote for Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate?

Yes, KEHONG BIO provides custom synthesis services for Dimethyl-bis[3-(octadec-9-enoylamino)propyl]azanium;methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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