Hexanoic acid, 6-amino-, isononyl ester
TL;DR: Hexanoic acid, 6-amino-, isononyl ester (CAS 72066-93-4) is a chemical compound with molecular formula C15H31NO2 and molecular weight 257.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyloctyl 6-aminohexanoate
Also Known As: Isononyl 6-aminohexanoate, 7-methyloctyl 6-aminohexanoate, Hexanoic acid, 6-amino-, isononyl ester, 6-Aminohexanoicacid7-methyloctylester, 6-Aminohexanoic acid 7-methyloctyl ester
| Molecular Formula | C15H31NO2 |
|---|---|
| Molecular Weight | 257.24 g/mol |
| LogP | 3.6552 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 257.23547 |
| Heavy Atoms | 18 |
| Complexity | 192.93262 |
Chemical Identifiers
| CAS Number | 72066-93-4 |
|---|---|
| SMILES | CC(C)CCCCCCOC(=O)CCCCCN |
Product Overview
Hexanoic acid, 6-amino-, isononyl ester (CAS 72066-93-4), with molecular formula C15H31NO2 and molecular weight 257.24 g/mol. IUPAC: 7-methyloctyl 6-aminohexanoate.
Chemical Property Profile of Hexanoic acid, 6-amino-, isononyl ester
Property Insights of Hexanoic acid, 6-amino-, isononyl ester
The XLogP value of 3.6552 indicates that Hexanoic acid, 6-amino-, isononyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.32 Ų, Hexanoic acid, 6-amino-, isononyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanoic acid, 6-amino-, isononyl ester has 1 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 Hexanoic acid, 6-amino-, isononyl ester?
The CAS number of Hexanoic acid, 6-amino-, isononyl ester is 72066-93-4.
What is the molecular formula of Hexanoic acid, 6-amino-, isononyl ester?
The molecular formula of Hexanoic acid, 6-amino-, isononyl ester is C15H31NO2.
What is the molecular weight of Hexanoic acid, 6-amino-, isononyl ester?
The molecular weight of Hexanoic acid, 6-amino-, isononyl ester is 257.24 g/mol.
Where can I buy Hexanoic acid, 6-amino-, isononyl ester?
You can request a quote for Hexanoic acid, 6-amino-, isononyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoic acid, 6-amino-, isononyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexanoic acid, 6-amino-, isononyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.