N-(2-Aminoethyl)-N'-octylethylenediamine
TL;DR: N-(2-Aminoethyl)-N'-octylethylenediamine (CAS 7261-59-8) is a chemical compound with molecular formula C12H29N3 and molecular weight 215.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[2-(octylamino)ethyl]ethane-1,2-diamine
Also Known As: n-octyldi-ethylenetriamine, N-(2-Aminoethyl)-N'-octylethylenediamine, N'-[2-(octylamino)ethyl]ethane-1,2-diamine, n-(2-aminoethyl)-n'-octylethane-1,2-diamine, N'-(2-aminoethyl)-N-octylethane-1,2-diamine
| Molecular Formula | C12H29N3 |
|---|---|
| Molecular Weight | 215.24 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 215.23615 |
| Heavy Atoms | 15 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 7261-59-8 |
|---|---|
| SMILES | CCCCCCCCNCCNCCN |
| InChIKey | YBUMEUMBIWOBBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-Aminoethyl)-N'-octylethylenediamine (CAS 7261-59-8), with molecular formula C12H29N3 and molecular weight 215.24 g/mol. IUPAC: N'-[2-(octylamino)ethyl]ethane-1,2-diamine.
Chemical Property Profile of N-(2-Aminoethyl)-N'-octylethylenediamine
Property Insights of N-(2-Aminoethyl)-N'-octylethylenediamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Aminoethyl)-N'-octylethylenediamine. With a topological polar surface area (TPSA) of 50.1 Ų, N-(2-Aminoethyl)-N'-octylethylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Aminoethyl)-N'-octylethylenediamine has 3 hydrogen bond donor(s) and 3 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 N-(2-Aminoethyl)-N'-octylethylenediamine?
The CAS number of N-(2-Aminoethyl)-N'-octylethylenediamine is 7261-59-8.
What is the molecular formula of N-(2-Aminoethyl)-N'-octylethylenediamine?
The molecular formula of N-(2-Aminoethyl)-N'-octylethylenediamine is C12H29N3.
What is the molecular weight of N-(2-Aminoethyl)-N'-octylethylenediamine?
The molecular weight of N-(2-Aminoethyl)-N'-octylethylenediamine is 215.24 g/mol.
Where can I buy N-(2-Aminoethyl)-N'-octylethylenediamine?
You can request a quote for N-(2-Aminoethyl)-N'-octylethylenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Aminoethyl)-N'-octylethylenediamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Aminoethyl)-N'-octylethylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.