Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
TL;DR: Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) (CAS 58793-73-0) is a chemical compound with molecular formula C16H35NO5 and molecular weight 321.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;decanoic acid
Also Known As: Decanoic acid triethanolamine salt, Decanoic acid, triethanolamine salt, 2-[bis(2-hydroxyethyl)amino]ethanol,decanoic acid, 2-[bis(2-hydroxyethyl)amino]ethanol; decanoic acid, Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
| Molecular Formula | C16H35NO5 |
|---|---|
| Molecular Weight | 321.25 g/mol |
| LogP | 1.477 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 321.25153 |
| Heavy Atoms | 22 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 58793-73-0 |
|---|---|
| SMILES | CCCCCCCCCC(=O)O.C(CO)N(CCO)CCO |
| InChIKey | GKHDHUDIDOQOFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) (CAS 58793-73-0), with molecular formula C16H35NO5 and molecular weight 321.25 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;decanoic acid.
Chemical Property Profile of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
Property Insights of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)
The XLogP value of 1.477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1). The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1). Following Lipinski's Rule of Five, Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) has 4 hydrogen bond donor(s) and 6 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 Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)?
The CAS number of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) is 58793-73-0.
What is the molecular formula of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)?
The molecular formula of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) is C16H35NO5.
What is the molecular weight of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)?
The molecular weight of Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) is 321.25 g/mol.
Where can I buy Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)?
You can request a quote for Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Decanoic acid, compound with 2,2',2''-nitrilotriethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.