Fumigatin oxide
TL;DR: Fumigatin oxide (CAS 1716-19-4) is a chemical compound with molecular formula C8H8O5 and molecular weight 184.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Fumigatin oxide
3-hydroxy-4-methoxy-1-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione
Also Known As: Fumigatin oxide, Fumigatin-oxide, 3-hydroxy-4-methoxy-1-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione, J2.370.951A, 4-Hydroxy-3-methoxy-6-methyl-7-oxabicyclo(4.1.0)hept-3-ene-2,5-dione
| Molecular Formula | C8H8O5 |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.03717 |
| Heavy Atoms | 13 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 1716-19-4 |
|---|---|
| SMILES | CC12C(O1)C(=O)C(=C(C2=O)O)OC |
| InChIKey | MCUVXXYOZCGKSY-UHFFFAOYSA-N |
Product Overview
Fumigatin oxide (CAS 1716-19-4), with molecular formula C8H8O5 and molecular weight 184.04 g/mol. IUPAC: 3-hydroxy-4-methoxy-1-methyl-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione.
Chemical Property Profile of Fumigatin oxide
Property Insights of Fumigatin oxide
The XLogP value of -0.2 indicates that Fumigatin oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Fumigatin oxide. Following Lipinski's Rule of Five, Fumigatin oxide has 1 hydrogen bond donor(s) and 5 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 Fumigatin oxide?
The CAS number of Fumigatin oxide is 1716-19-4.
What is the molecular formula of Fumigatin oxide?
The molecular formula of Fumigatin oxide is C8H8O5.
What is the molecular weight of Fumigatin oxide?
The molecular weight of Fumigatin oxide is 184.04 g/mol.
Where can I buy Fumigatin oxide?
You can request a quote for Fumigatin oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fumigatin oxide?
Yes, KEHONG BIO provides custom synthesis services for Fumigatin oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.