all-trans-5,6-Epoxyretinoic acid
TL;DR: all-trans-5,6-Epoxyretinoic acid (CAS 3012-76-8) is a chemical compound with molecular formula C20H28O3 and molecular weight 316.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenoic acid
Also Known As: 5,6-Epoxyretinoic acid, all-trans 5,6-Epoxy Retinoic Acid, all-trans-5,6-Epoxyretinoic acid, 5,6-Epoxyretinoicacid, Tretinoin EP Impurity G
| Molecular Formula | C20H28O3 |
|---|---|
| Molecular Weight | 316.20 g/mol |
| LogP | 4.8138 |
| Topological Polar Surface Area | 49.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.20386 |
| Heavy Atoms | 23 |
| Complexity | 606.37634 |
Chemical Identifiers
| CAS Number | 3012-76-8 |
|---|---|
| SMILES | C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C12C(CCCC1(O2)C)(C)C |
Product Overview
all-trans-5,6-Epoxyretinoic acid (CAS 3012-76-8), with molecular formula C20H28O3 and molecular weight 316.20 g/mol. IUPAC: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenoic acid.
Chemical Property Profile of all-trans-5,6-Epoxyretinoic acid
Property Insights of all-trans-5,6-Epoxyretinoic acid
The XLogP value of 4.8138 indicates that all-trans-5,6-Epoxyretinoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.83 Ų, all-trans-5,6-Epoxyretinoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, all-trans-5,6-Epoxyretinoic acid has 1 hydrogen bond donor(s) and 2 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 all-trans-5,6-Epoxyretinoic acid?
The CAS number of all-trans-5,6-Epoxyretinoic acid is 3012-76-8.
What is the molecular formula of all-trans-5,6-Epoxyretinoic acid?
The molecular formula of all-trans-5,6-Epoxyretinoic acid is C20H28O3.
What is the molecular weight of all-trans-5,6-Epoxyretinoic acid?
The molecular weight of all-trans-5,6-Epoxyretinoic acid is 316.20 g/mol.
Where can I buy all-trans-5,6-Epoxyretinoic acid?
You can request a quote for all-trans-5,6-Epoxyretinoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for all-trans-5,6-Epoxyretinoic acid?
Yes, KEHONG BIO provides custom synthesis services for all-trans-5,6-Epoxyretinoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.