莱烯内酯
TL;DR: 莱烯内酯 (CAS 675-09-2) is a chemical compound with molecular formula C7H8O2 and molecular weight 124.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
莱烯内酯
4,6-dimethylpyran-2-one
Also Known As: 4,6-Dimethyl-2H-pyran-2-one, 4,6-Dimethyl-2-pyrone, Mesitene lactone, 4,6-dimethylpyran-2-one, 4,6-Dimethylcoumalin
| Molecular Formula | C7H8O2 |
|---|---|
| Molecular Weight | 124.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.05243 |
| Heavy Atoms | 9 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 675-09-2 |
|---|---|
| SMILES | CC1=CC(=O)OC(=C1)C |
| InChIKey | IXYLIUKQQQXXON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
莱烯内酯 (CAS 675-09-2), with molecular formula C7H8O2 and molecular weight 124.05 g/mol. IUPAC: 4,6-dimethylpyran-2-one.
Chemical Property Profile of 莱烯内酯
Property Insights of 莱烯内酯
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 莱烯内酯. With a topological polar surface area (TPSA) of 26.3 Ų, 莱烯内酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 莱烯内酯 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
Frequently Asked Questions
What is the CAS number of 莱烯内酯?
The CAS number of 莱烯内酯 is 675-09-2.
What is the molecular formula of 莱烯内酯?
The molecular formula of 莱烯内酯 is C7H8O2.
What is the molecular weight of 莱烯内酯?
The molecular weight of 莱烯内酯 is 124.05 g/mol.
Where can I buy 莱烯内酯?
You can request a quote for 莱烯内酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 莱烯内酯?
Yes, KEHONG BIO provides custom synthesis services for 莱烯内酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.