Monocerin
TL;DR: Monocerin (CAS 30270-60-1) is a chemical compound with molecular formula C16H20O6 and molecular weight 308.12598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3aR,9bR)-6-hydroxy-7,8-dimethoxy-2-propyl-2,3,3a,9b-tetrahydrofuro[3,2-c]isochromen-5-one
Also Known As: Monocerin, (+)-MONOCERIN, MONOCERIN, (+)-, MEGxm0_000272, ACon0_000652
Technical Specifications
| Molecular Formula | C16H20O6 |
| Molecular Weight | 308.12598 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.12598 Da |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
| SMILES | CCC[C@H]1C[C@@H]2[C@H](O1)C3=CC(=C(C(=C3C(=O)O2)O)OC)OC |
| InChIKey | VAYQNUBOZLPGDH-OLXJLDBKSA-N |
Chemical Property Profile of Monocerin
Property Insights of Monocerin
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Monocerin. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Monocerin. Following Lipinski's Rule of Five, Monocerin has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Monocerin?
The CAS number of Monocerin is 30270-60-1.
What is the molecular formula of Monocerin?
The molecular formula of Monocerin is C16H20O6.
What is the molecular weight of Monocerin?
The molecular weight of Monocerin is 308.12598 g/mol.
Where can I buy Monocerin?
You can request a quote for Monocerin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Monocerin?
Yes, CoreyChem provides custom synthesis services for Monocerin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.