Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)
TL;DR: Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) (CAS 68052-35-7) is a chemical compound with molecular formula C14H31NO3 and molecular weight 261.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethanol;octanoic acid
Also Known As: Diethylethanolamine caprylate, Octanoic acid diethylethanolamine salt, 2-(diethylamino)ethanol,octanoic acid, 2-(diethylamino)ethanol; octanoic acid, Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)
| Molecular Formula | C14H31NO3 |
|---|---|
| Molecular Weight | 261.23 g/mol |
| LogP | 2.752 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 261.2304 |
| Heavy Atoms | 18 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 68052-35-7 |
|---|---|
| SMILES | CCCCCCCC(=O)O.CCN(CC)CCO |
| InChIKey | SBKDOVGGFMYFDW-UHFFFAOYSA-N |
Product Overview
Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) (CAS 68052-35-7), with molecular formula C14H31NO3 and molecular weight 261.23 g/mol. IUPAC: 2-(diethylamino)ethanol;octanoic acid.
Chemical Property Profile of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)
Property Insights of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)
The XLogP value of 2.752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1). The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1). Following Lipinski's Rule of Five, Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) has 2 hydrogen bond donor(s) and 4 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 2-(diethylamino)ethanol (1:1)?
The CAS number of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) is 68052-35-7.
What is the molecular formula of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)?
The molecular formula of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) is C14H31NO3.
What is the molecular weight of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)?
The molecular weight of Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) is 261.23 g/mol.
Where can I buy Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1)?
You can request a quote for Octanoic acid, compd. with 2-(diethylamino)ethanol (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 2-(diethylamino)ethanol (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Octanoic acid, compd. with 2-(diethylamino)ethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.