(-)-Harveynone
TL;DR: (-)-Harveynone (CAS 125555-67-1) is a chemical compound with molecular formula C11H10O3 and molecular weight 190.06299 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,5R,6S)-5-hydroxy-3-(3-methylbut-3-en-1-ynyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one
Also Known As: (-)-Harveynone, (-)-PT-toxin, (1S,2R,6S)-2-Hydroxy-4-(3-methylbut-3-en-1-ynyl)-7-oxabicyclo(4.1.0)hept-3-en-5-one, (1S,2R,6S)-2-hydroxy-4-(3-methylbut-3-en-1-ynyl)-7-oxabicyclo[4.1.0]hept-3-en-5-one, (1S,5R,6S)-5-hydroxy-3-(3-methylbut-3-en-1-ynyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one
Technical Specifications
| Molecular Formula | C11H10O3 |
| Molecular Weight | 190.06299 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.06299 Da |
| Heavy Atoms | 14 |
| Complexity | 405.0 |
| SMILES | CC(=C)C#CC1=C[C@H]([C@H]2[C@@H](C1=O)O2)O |
| InChIKey | PQAVKHOYIGJVBH-DVVUODLYSA-N |
Chemical Property Profile of (-)-Harveynone
Property Insights of (-)-Harveynone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-Harveynone. With a topological polar surface area (TPSA) of 49.8 Ų, (-)-Harveynone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-Harveynone has 1 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 (-)-Harveynone?
The CAS number of (-)-Harveynone is 125555-67-1.
What is the molecular formula of (-)-Harveynone?
The molecular formula of (-)-Harveynone is C11H10O3.
What is the molecular weight of (-)-Harveynone?
The molecular weight of (-)-Harveynone is 190.06299 g/mol.
Where can I buy (-)-Harveynone?
You can request a quote for (-)-Harveynone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (-)-Harveynone?
Yes, CoreyChem provides custom synthesis services for (-)-Harveynone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.