Invictolide
TL;DR: Invictolide (CAS 111810-95-8) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,5R,6S)-3,5-dimethyl-6-[(2R)-pentan-2-yl]oxan-2-one
Also Known As: Invictolide, (-)-Invictolide, 3,6,7-Tri-epi-invictolide, KST-1A0561, (3R,5R,6S)-3,5-dimethyl-6-[(2R)-pentan-2-yl]oxan-2-one
Technical Specifications
| Molecular Formula | C12H22O2 |
| Molecular Weight | 198.16199 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.16199 Da |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
| SMILES | CCC[C@@H](C)[C@H]1[C@@H](C[C@H](C(=O)O1)C)C |
| InChIKey | AZBHSLUQWMFDHU-DBIOUOCHSA-N |
Chemical Property Profile of Invictolide
Property Insights of Invictolide
The XLogP value of 3.8 indicates that Invictolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Invictolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Invictolide has 0 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 Invictolide?
The CAS number of Invictolide is 111810-95-8.
What is the molecular formula of Invictolide?
The molecular formula of Invictolide is C12H22O2.
What is the molecular weight of Invictolide?
The molecular weight of Invictolide is 198.16199 g/mol.
Where can I buy Invictolide?
You can request a quote for Invictolide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Invictolide?
Yes, CoreyChem provides custom synthesis services for Invictolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.