4-Keto Retinol
TL;DR: 4-Keto Retinol (CAS 1076198-35-0) is a chemical compound with molecular formula C20H28O2 and molecular weight 300.20892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl)-2,4,4-trimethylcyclohex-2-en-1-one
Also Known As: 4-Keto Retinol, 9-cis-4-Ketoretinol, 3-(9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl)-2,4,4-trimethylcyclohex-2-en-1-one, 3-[(1E,3E,5E,7E)-9-hydroxy-3,7-dimethyl-nona-1,3,5,7-tetraenyl]-2,4,4-trimethyl-cyclohex-2-en-1-one, OXR
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H28O2 |
| Molecular Weight | 300.20892 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.20892 Da |
| Heavy Atoms | 22 |
| Complexity | 567.0 |
| SMILES | CC1=C(C(CCC1=O)(C)C)C=CC(=CC=CC(=CCO)C)C |
| InChIKey | PLIUCYCUYQIBDZ-UHFFFAOYSA-N |
Chemical Property Profile of 4-Keto Retinol
Property Insights of 4-Keto Retinol
The XLogP value of 4.6 indicates that 4-Keto Retinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Keto Retinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Keto Retinol 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
What is the CAS number of 4-Keto Retinol?
The CAS number of 4-Keto Retinol is 1076198-35-0.
What is the molecular formula of 4-Keto Retinol?
The molecular formula of 4-Keto Retinol is C20H28O2.
What is the molecular weight of 4-Keto Retinol?
The molecular weight of 4-Keto Retinol is 300.20892 g/mol.
Where can I buy 4-Keto Retinol?
You can request a quote for 4-Keto Retinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Keto Retinol?
Yes, CoreyChem provides custom synthesis services for 4-Keto Retinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.