1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt
TL;DR: 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt (CAS 34135-79-0) is a chemical compound with molecular formula C13H27NO2 and molecular weight 229.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(trimethylazaniumyl)decanoate
Also Known As: octylbetaine, 2-(trimethylazaniumyl)decanoate, 2-(trimethylammonio)decanoate, (1-Carboxylatononyl)trimethylammonium, (1-Carboxylatononyl)trimethylaminium
| Molecular Formula | C13H27NO2 |
|---|---|
| Molecular Weight | 229.20 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 229.20418 |
| Heavy Atoms | 16 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 34135-79-0 |
|---|---|
| SMILES | CCCCCCCCC(C(=O)[O-])[N+](C)(C)C |
| InChIKey | AATOGXGPMOMOQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt (CAS 34135-79-0), with molecular formula C13H27NO2 and molecular weight 229.20 g/mol. IUPAC: 2-(trimethylazaniumyl)decanoate.
Chemical Property Profile of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt
Property Insights of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt
The XLogP value of 4.5 indicates that 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.1 Ų, 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt?
The CAS number of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt is 34135-79-0.
What is the molecular formula of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt?
The molecular formula of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt is C13H27NO2.
What is the molecular weight of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt?
The molecular weight of 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt is 229.20 g/mol.
Where can I buy 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt?
You can request a quote for 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt?
Yes, KEHONG BIO provides custom synthesis services for 1-nonanaminium, 1-carboxy-n,n,n-trimethyl-, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.