9-cis-RetinylStearate-d5
TL;DR: 9-cis-RetinylStearate-d5 (CAS 1331643-11-8) is a chemical compound with molecular formula C38H64O2 and molecular weight 552.49066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] octadecanoate
Also Known As: 9-cis-Retinyl Stearate, all-trans-retinyl stearate, 9-cis-RetinylStearate-d5, 9-cis-Retinyl Stearate-d5, [(2E,4E,6Z,8E)-9-[3,3-dideuterio-6,6-dimethyl-2-(trideuteriomethyl)cyclohexen-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenyl] octadecanoate
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C38H64O2 |
| Molecular Weight | 552.49066 g/mol |
| XLogP | 14.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Exact Mass | 552.49066 Da |
| Heavy Atoms | 40 |
| Complexity | 834.0 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(CCCC1(C)C)C |
| InChIKey | YNGACJMSLZMZOX-UHFFFAOYSA-N |
Chemical Property Profile of 9-cis-RetinylStearate-d5
Property Insights of 9-cis-RetinylStearate-d5
The XLogP value of 14.7 indicates that 9-cis-RetinylStearate-d5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 9-cis-RetinylStearate-d5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-cis-RetinylStearate-d5 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 9-cis-RetinylStearate-d5?
The CAS number of 9-cis-RetinylStearate-d5 is 1331643-11-8.
What is the molecular formula of 9-cis-RetinylStearate-d5?
The molecular formula of 9-cis-RetinylStearate-d5 is C38H64O2.
What is the molecular weight of 9-cis-RetinylStearate-d5?
The molecular weight of 9-cis-RetinylStearate-d5 is 552.49066 g/mol.
Where can I buy 9-cis-RetinylStearate-d5?
You can request a quote for 9-cis-RetinylStearate-d5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-cis-RetinylStearate-d5?
Yes, CoreyChem provides custom synthesis services for 9-cis-RetinylStearate-d5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.