N-Methyl-N-oleoyltaurine
TL;DR: N-Methyl-N-oleoyltaurine (CAS 97-80-3) is a chemical compound with molecular formula C21H41NO4S and molecular weight 403.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl-[(Z)-octadec-9-enoyl]amino]ethanesulfonic acid
Also Known As: Arkopon, Oleylmethyltaurine, Sapogen T, Metaupon, N-Oleoyl-N-methyltaurine
| Molecular Formula | C21H41NO4S |
|---|---|
| Molecular Weight | 403.28 g/mol |
| LogP | 5.3701 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 403.27563 |
| Heavy Atoms | 27 |
| Complexity | 488.41006 |
Chemical Identifiers
| CAS Number | 97-80-3 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CCS(=O)(=O)O |
Product Overview
N-Methyl-N-oleoyltaurine (CAS 97-80-3), with molecular formula C21H41NO4S and molecular weight 403.28 g/mol. IUPAC: 2-[methyl-[(Z)-octadec-9-enoyl]amino]ethanesulfonic acid.
Chemical Property Profile of N-Methyl-N-oleoyltaurine
Property Insights of N-Methyl-N-oleoyltaurine
The XLogP value of 5.3701 indicates that N-Methyl-N-oleoyltaurine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-N-oleoyltaurine. Following Lipinski's Rule of Five, N-Methyl-N-oleoyltaurine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Methyl-N-oleoyltaurine?
The CAS number of N-Methyl-N-oleoyltaurine is 97-80-3.
What is the molecular formula of N-Methyl-N-oleoyltaurine?
The molecular formula of N-Methyl-N-oleoyltaurine is C21H41NO4S.
What is the molecular weight of N-Methyl-N-oleoyltaurine?
The molecular weight of N-Methyl-N-oleoyltaurine is 403.28 g/mol.
Where can I buy N-Methyl-N-oleoyltaurine?
You can request a quote for N-Methyl-N-oleoyltaurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-N-oleoyltaurine?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-N-oleoyltaurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.