5,6-Monoepoxyretinyl acetate
TL;DR: 5,6-Monoepoxyretinyl acetate (CAS 801-72-9) is a chemical compound with molecular formula C22H32O3 and molecular weight 344.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenyl] acetate
Also Known As: 5,6-Monoepoxyretinyl acetate
| Molecular Formula | C22H32O3 |
|---|---|
| Molecular Weight | 344.24 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.23514 |
| Heavy Atoms | 25 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 801-72-9 |
|---|---|
| SMILES | CC(=CCOC(=O)C)C=CC=C(C)C=CC12C(CCCC1(O2)C)(C)C |
| InChIKey | AZAWTSYUQKXIGK-UHFFFAOYSA-N |
Product Overview
5,6-Monoepoxyretinyl acetate (CAS 801-72-9), with molecular formula C22H32O3 and molecular weight 344.24 g/mol. IUPAC: [3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenyl] acetate.
Chemical Property Profile of 5,6-Monoepoxyretinyl acetate
Property Insights of 5,6-Monoepoxyretinyl acetate
The XLogP value of 5.4 indicates that 5,6-Monoepoxyretinyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 5,6-Monoepoxyretinyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Monoepoxyretinyl acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6-Monoepoxyretinyl acetate?
The CAS number of 5,6-Monoepoxyretinyl acetate is 801-72-9.
What is the molecular formula of 5,6-Monoepoxyretinyl acetate?
The molecular formula of 5,6-Monoepoxyretinyl acetate is C22H32O3.
What is the molecular weight of 5,6-Monoepoxyretinyl acetate?
The molecular weight of 5,6-Monoepoxyretinyl acetate is 344.24 g/mol.
Where can I buy 5,6-Monoepoxyretinyl acetate?
You can request a quote for 5,6-Monoepoxyretinyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Monoepoxyretinyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Monoepoxyretinyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.