2',3'-Epoxyisocapnolactone
TL;DR: 2',3'-Epoxyisocapnolactone (CAS 638166-71-9) is a chemical compound with molecular formula C19H18O6 and molecular weight 342.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[[(2S,3S)-3-methyl-3-[[(2S)-4-methylidene-5-oxooxolan-2-yl]methyl]oxiran-2-yl]methoxy]chromen-2-one
Also Known As: 2',3'-Epoxyisocapnolactone, 4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7,8-dihydroxy-3,5-dimethoxy-, 7-[3-Methyl-3-(3-methylene-4-oxo-cyclopentylmethyl)-oxiranylmethoxy]-chromen-2-one, 7-[((2S,3S)-3-methyl-3-{[(2S)-4-methylene-5-oxotetrahydrofuran-2-yl]methyl}oxiran-2-yl)methoxy]-2H-chromen-2-one (non-preferred name), 7-[[(2S,3S)-3-methyl-3-[[(2S)-4-methylidene-5-oxooxolan-2-yl]methyl]oxiran-2-yl]methoxy]chromen-2-one
| Molecular Formula | C19H18O6 |
|---|---|
| Molecular Weight | 342.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 74.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.11035 |
| Heavy Atoms | 25 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 638166-71-9 |
|---|---|
| SMILES | C[C@@]1([C@@H](O1)COC2=CC3=C(C=C2)C=CC(=O)O3)C[C@@H]4CC(=C)C(=O)O4 |
| InChIKey | BSQOZNKTJBOYCC-QOKNQOGYSA-N |
Product Overview
2',3'-Epoxyisocapnolactone (CAS 638166-71-9), with molecular formula C19H18O6 and molecular weight 342.11 g/mol. IUPAC: 7-[[(2S,3S)-3-methyl-3-[[(2S)-4-methylidene-5-oxooxolan-2-yl]methyl]oxiran-2-yl]methoxy]chromen-2-one.
Chemical Property Profile of 2',3'-Epoxyisocapnolactone
Property Insights of 2',3'-Epoxyisocapnolactone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',3'-Epoxyisocapnolactone. The TPSA of 74.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2',3'-Epoxyisocapnolactone. Following Lipinski's Rule of Five, 2',3'-Epoxyisocapnolactone has 0 hydrogen bond donor(s) and 6 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 2',3'-Epoxyisocapnolactone?
The CAS number of 2',3'-Epoxyisocapnolactone is 638166-71-9.
What is the molecular formula of 2',3'-Epoxyisocapnolactone?
The molecular formula of 2',3'-Epoxyisocapnolactone is C19H18O6.
What is the molecular weight of 2',3'-Epoxyisocapnolactone?
The molecular weight of 2',3'-Epoxyisocapnolactone is 342.11 g/mol.
Where can I buy 2',3'-Epoxyisocapnolactone?
You can request a quote for 2',3'-Epoxyisocapnolactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',3'-Epoxyisocapnolactone?
Yes, KEHONG BIO provides custom synthesis services for 2',3'-Epoxyisocapnolactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.