![3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate structure](/static/products/918/91820-48-3.png)
3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate
TL;DR: 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate (CAS 91820-48-3) is a chemical compound with molecular formula C22H41NO5 and molecular weight 399.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-ethylhexanoyloxy)propanoylamino]propyl 2-ethylhexanoate
Also Known As: 3-({2-[(2-ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate, 3-[2-(2-ethylhexanoyloxy)propanoylamino]propyl 2-ethylhexano, 3-[2-(2-ethylhexanoyloxy)propanoylamino]propyl 2-ethylhexanoate, 3-{2-[(2-ETHYLHEXANOYL)OXY]PROPANAMIDO}PROPYL 2-ETHYLHEXANOATE, 2-ethyl-hexanoic acid 1-[3-(2-ethyl-hexanoyloxy)-propylcarbamoyl]-ethyl ester
| Molecular Formula | C22H41NO5 |
|---|---|
| Molecular Weight | 399.30 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 399.29846 |
| Heavy Atoms | 28 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 91820-48-3 |
|---|---|
| SMILES | CCCCC(CC)C(=O)OCCCNC(=O)C(C)OC(=O)C(CC)CCCC |
| InChIKey | PIVXTLFIOLOFOJ-UHFFFAOYSA-N |
Product Overview
3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate (CAS 91820-48-3), with molecular formula C22H41NO5 and molecular weight 399.30 g/mol. IUPAC: 3-[2-(2-ethylhexanoyloxy)propanoylamino]propyl 2-ethylhexanoate.
Chemical Property Profile of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate
Property Insights of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate
The XLogP value of 5.8 indicates that 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate. Following Lipinski's Rule of Five, 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate?
The CAS number of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate is 91820-48-3.
What is the molecular formula of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate?
The molecular formula of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate is C22H41NO5.
What is the molecular weight of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate?
The molecular weight of 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate is 399.30 g/mol.
Where can I buy 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate?
You can request a quote for 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-({2-[(2-Ethylhexanoyl)oxy]propanoyl}amino)propyl 2-ethylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.