Octanoic acid, compd. with 1-octanamine (1:1)
TL;DR: Octanoic acid, compd. with 1-octanamine (1:1) (CAS 672-46-8) is a chemical compound with molecular formula C16H35NO2 and molecular weight 273.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octan-1-amine;octanoic acid
Also Known As: Caprylamine caprylate, octan-1-amine;octanoic acid, octan-1-amine; octanoic acid, octan-1-amine,octanoic acid, Octanoic acid, compd. with 1-octanamine (1:1)
| Molecular Formula | C16H35NO2 |
|---|---|
| Molecular Weight | 273.27 g/mol |
| LogP | 4.7371 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 273.26678 |
| Heavy Atoms | 19 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 672-46-8 |
|---|---|
| SMILES | CCCCCCCCN.CCCCCCCC(=O)O |
| InChIKey | LQNPIBHEOATAEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octanoic acid, compd. with 1-octanamine (1:1) (CAS 672-46-8), with molecular formula C16H35NO2 and molecular weight 273.27 g/mol. IUPAC: octan-1-amine;octanoic acid.
Chemical Property Profile of Octanoic acid, compd. with 1-octanamine (1:1)
Property Insights of Octanoic acid, compd. with 1-octanamine (1:1)
The XLogP value of 4.7371 indicates that Octanoic acid, compd. with 1-octanamine (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Octanoic acid, compd. with 1-octanamine (1:1). Following Lipinski's Rule of Five, Octanoic acid, compd. with 1-octanamine (1:1) has 2 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 Octanoic acid, compd. with 1-octanamine (1:1)?
The CAS number of Octanoic acid, compd. with 1-octanamine (1:1) is 672-46-8.
What is the molecular formula of Octanoic acid, compd. with 1-octanamine (1:1)?
The molecular formula of Octanoic acid, compd. with 1-octanamine (1:1) is C16H35NO2.
What is the molecular weight of Octanoic acid, compd. with 1-octanamine (1:1)?
The molecular weight of Octanoic acid, compd. with 1-octanamine (1:1) is 273.27 g/mol.
Where can I buy Octanoic acid, compd. with 1-octanamine (1:1)?
You can request a quote for Octanoic acid, compd. with 1-octanamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octanoic acid, compd. with 1-octanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Octanoic acid, compd. with 1-octanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.