2-Ethylhexyl syringate
TL;DR: 2-Ethylhexyl syringate (CAS 90510-21-7) is a chemical compound with molecular formula C17H26O5 and molecular weight 310.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 4-hydroxy-3,5-dimethoxybenzoate
Also Known As: 2-ethylhexyl syringate, 2-ethylhexyl 4-hydroxy-3,5-dimethoxybenzoate, 2-ethylhexyl 4-hydroxy-3,5-dimethoxy-benzoate
| Molecular Formula | C17H26O5 |
|---|---|
| Molecular Weight | 310.18 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.178 |
| Heavy Atoms | 22 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 90510-21-7 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)C1=CC(=C(C(=C1)OC)O)OC |
| InChIKey | NAPPRLSERFERCY-UHFFFAOYSA-N |
Product Overview
2-Ethylhexyl syringate (CAS 90510-21-7), with molecular formula C17H26O5 and molecular weight 310.18 g/mol. IUPAC: 2-ethylhexyl 4-hydroxy-3,5-dimethoxybenzoate.
Chemical Property Profile of 2-Ethylhexyl syringate
Property Insights of 2-Ethylhexyl syringate
The XLogP value of 4.5 indicates that 2-Ethylhexyl syringate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethylhexyl syringate. Following Lipinski's Rule of Five, 2-Ethylhexyl syringate has 1 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 syringate?
The CAS number of 2-Ethylhexyl syringate is 90510-21-7.
What is the molecular formula of 2-Ethylhexyl syringate?
The molecular formula of 2-Ethylhexyl syringate is C17H26O5.
What is the molecular weight of 2-Ethylhexyl syringate?
The molecular weight of 2-Ethylhexyl syringate is 310.18 g/mol.
Where can I buy 2-Ethylhexyl syringate?
You can request a quote for 2-Ethylhexyl syringate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl syringate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl syringate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.