Ethyl retinoate
TL;DR: Ethyl retinoate (CAS 3899-20-5) is a chemical compound with molecular formula C22H32O2 and molecular weight 328.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z,4E,6Z,8Z)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
Also Known As: Ethyl retinoate, ethylretinoate, ethyl (2Z,4E,6Z,8Z)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
| Molecular Formula | C22H32O2 |
|---|---|
| Molecular Weight | 328.24 g/mol |
| LogP | 6.0811 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.24023 |
| Heavy Atoms | 24 |
| Complexity | 595.4595 |
Chemical Identifiers
| CAS Number | 3899-20-5 |
|---|---|
| SMILES | CCOC(=O)/C=C(/C)\C=C\C=C(\C)/C=C\C1=C(CCCC1(C)C)C |
Product Overview
Ethyl retinoate (CAS 3899-20-5), with molecular formula C22H32O2 and molecular weight 328.24 g/mol. IUPAC: ethyl (2Z,4E,6Z,8Z)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate.
Chemical Property Profile of Ethyl retinoate
Property Insights of Ethyl retinoate
The XLogP value of 6.0811 indicates that Ethyl retinoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl retinoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl retinoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl retinoate?
The CAS number of Ethyl retinoate is 3899-20-5.
What is the molecular formula of Ethyl retinoate?
The molecular formula of Ethyl retinoate is C22H32O2.
What is the molecular weight of Ethyl retinoate?
The molecular weight of Ethyl retinoate is 328.24 g/mol.
Where can I buy Ethyl retinoate?
You can request a quote for Ethyl retinoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl retinoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl retinoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.