2-Ethylhexyl 3-methoxypropyl adipate
TL;DR: 2-Ethylhexyl 3-methoxypropyl adipate (CAS 85670-21-9) is a chemical compound with molecular formula C18H34O5 and molecular weight 330.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-O-(2-ethylhexyl) 1-O-(3-methoxypropyl) hexanedioate
Also Known As: 2-Ethylhexyl 3-methoxypropyl adipate, EINECS 288-185-6, 2-ethylhexyl3-methoxypropyladipate, 2-Ethylhexyl 3-methoxypropyl hexanedioate, Hexanedioic acid,1-(2-ethylhexyl) 6-(3-methoxypropyl) ester
| Molecular Formula | C18H34O5 |
|---|---|
| Molecular Weight | 330.24 g/mol |
| LogP | 3.8861 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 330.24063 |
| Heavy Atoms | 23 |
| Complexity | 303.78708 |
Chemical Identifiers
| CAS Number | 85670-21-9 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)CCCCC(=O)OCCCOC |
Product Overview
2-Ethylhexyl 3-methoxypropyl adipate (CAS 85670-21-9), with molecular formula C18H34O5 and molecular weight 330.24 g/mol. IUPAC: 6-O-(2-ethylhexyl) 1-O-(3-methoxypropyl) hexanedioate.
Chemical Property Profile of 2-Ethylhexyl 3-methoxypropyl adipate
Property Insights of 2-Ethylhexyl 3-methoxypropyl adipate
The XLogP value of 3.8861 indicates that 2-Ethylhexyl 3-methoxypropyl adipate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethylhexyl 3-methoxypropyl adipate. Following Lipinski's Rule of Five, 2-Ethylhexyl 3-methoxypropyl adipate has 0 hydrogen bond donor(s) and 5 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 2-Ethylhexyl 3-methoxypropyl adipate?
The CAS number of 2-Ethylhexyl 3-methoxypropyl adipate is 85670-21-9.
What is the molecular formula of 2-Ethylhexyl 3-methoxypropyl adipate?
The molecular formula of 2-Ethylhexyl 3-methoxypropyl adipate is C18H34O5.
What is the molecular weight of 2-Ethylhexyl 3-methoxypropyl adipate?
The molecular weight of 2-Ethylhexyl 3-methoxypropyl adipate is 330.24 g/mol.
Where can I buy 2-Ethylhexyl 3-methoxypropyl adipate?
You can request a quote for 2-Ethylhexyl 3-methoxypropyl adipate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl 3-methoxypropyl adipate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl 3-methoxypropyl adipate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.