Ammonium 2-ethylhexanoate
TL;DR: Ammonium 2-ethylhexanoate (CAS 15590-60-0) is a chemical compound with molecular formula C8H19NO2 and molecular weight 161.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azane;2-ethylhexanoic acid
Also Known As: Ammonium 2-ethylhexanoate, azane;2-ethylhexanoic acid, azanium,2-ethylhexanoate, azane; 2-ethylhexanoic acid, Hexanoicacid,2-ethyl-,ammoniumsalt
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H19NO2 |
| Molecular Weight | 161.14159 g/mol |
| XLogP | 2.45 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 161.14159 Da |
| Heavy Atoms | 11 |
| Complexity | 99.0 |
| SMILES | CCCCC(CC)C(=O)O.N |
| InChIKey | JQQFHYGWOCWHFI-UHFFFAOYSA-N |
Chemical Property Profile of Ammonium 2-ethylhexanoate
Property Insights of Ammonium 2-ethylhexanoate
The XLogP value of 2.45 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium 2-ethylhexanoate. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium 2-ethylhexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium 2-ethylhexanoate 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
What is the CAS number of Ammonium 2-ethylhexanoate?
The CAS number of Ammonium 2-ethylhexanoate is 15590-60-0.
What is the molecular formula of Ammonium 2-ethylhexanoate?
The molecular formula of Ammonium 2-ethylhexanoate is C8H19NO2.
What is the molecular weight of Ammonium 2-ethylhexanoate?
The molecular weight of Ammonium 2-ethylhexanoate is 161.14159 g/mol.
Where can I buy Ammonium 2-ethylhexanoate?
You can request a quote for Ammonium 2-ethylhexanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium 2-ethylhexanoate?
Yes, CoreyChem provides custom synthesis services for Ammonium 2-ethylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.