1-Oxomiltirone
TL;DR: 1-Oxomiltirone (CAS 142546-16-5) is a chemical compound with molecular formula C19H20O3 and molecular weight 296.14124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8,8-dimethyl-2-propan-2-yl-6,7-dihydrophenanthrene-3,4,5-trione
Also Known As: 1-oxomiltirone, HY-N10703, J1.641.890K, 8,8-dimethyl-2-propan-2-yl-6,7-dihydrophenanthrene-3,4,5-trione, 2-Isopropyl-8,8-dimethyl-7,8-dihydrophenanthrene-3,4,5(6H)-trione
Technical Specifications
| Molecular Formula | C19H20O3 |
| Molecular Weight | 296.14124 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.14124 Da |
| Heavy Atoms | 22 |
| Complexity | 567.0 |
| SMILES | CC(C)C1=CC2=C(C3=C(C=C2)C(CCC3=O)(C)C)C(=O)C1=O |
| InChIKey | VPIMKJVQYOXHSS-UHFFFAOYSA-N |
Chemical Property Profile of 1-Oxomiltirone
Property Insights of 1-Oxomiltirone
The XLogP value of 3.6 indicates that 1-Oxomiltirone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 1-Oxomiltirone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxomiltirone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Oxomiltirone?
The CAS number of 1-Oxomiltirone is 142546-16-5.
What is the molecular formula of 1-Oxomiltirone?
The molecular formula of 1-Oxomiltirone is C19H20O3.
What is the molecular weight of 1-Oxomiltirone?
The molecular weight of 1-Oxomiltirone is 296.14124 g/mol.
Where can I buy 1-Oxomiltirone?
You can request a quote for 1-Oxomiltirone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Oxomiltirone?
Yes, CoreyChem provides custom synthesis services for 1-Oxomiltirone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.